Dataset - NFDI4Chem Search Service

Supplementary material for 'Influence of Layer Slipping on Adsorption of Ligh... Dataset

This dataset contains results from Grand Canonical Monte Carlo (GCMC) Simulation (data/isotherms_sim/) and experiment (data/isotherms/exp). All Data is presented in a jupyter...
- HTML

You can also access this registry using the API (see API Docs).

Versions

Installed Packages

Installation paths relative to:

/usr/lib/ckan/default/lib/python3.7/site-packages

Package	Version	Installed Path
aiosmtpd	1.4.4.post2
alabaster	0.7.12
alembic	1.6.5
annotated-types	0.5.0
appdirs	1.4.4
APScheduler	2.1.2
arrow	1.1.1
asciinema	2.0.2
asciitree	0.3.3
asgiref	3.4.1
async-timeout	4.0.3
atomicwrites	1.4.0
atpublic	3.1.2
attrs	21.2.0
Babel	2.7.0
backcall	0.2.0
backports.entry-points-selectable	1.1.0
backports.zoneinfo	0.2.1
bcrypt	4.0.1
Beaker	1.11.0
beautifulsoup4	4.8.2
binaryornot	0.4.4
bleach	3.3.0
blinker	1.4
boto3	1.33.13
botocore	1.33.13
bs4	0.0.1
build	1.0.3
cached-property	1.5.1
certifi	2021.5.30
cffi	1.14.6
chardet	3.0.4
charset-normalizer	3.3.2
ckan	2.9.8
ckanapi	4.7	ckanapi-4.7-py3.7.egg
ckanapi-exporter	0.1.0
ckanext-bioschemaharvester	0.1.5	/usr/lib/ckan/default/src/ckanext-bioschemaharvester
ckanext-composite-search	0.3.1
ckanext-datapackager	1.1.0	/usr/lib/ckan/default/src/ckanext-datapackager
ckanext-dataverse	1.0.0
ckanext-dcat	1.1.3
ckanext-footer	0.0.1
ckanext-harvest	1.5.6
ckanext-hidepremissions	0.0.1
ckanext-massbankharvester	0.0.1
ckanext-metadataschema	0.0.1	/usr/lib/ckan/default/src/ckanext-metadataschema
ckanext-oai-metadataschema	0.0.1
ckanext-oaipmh	0.1
ckanext-oaipmh-dc	1.1
ckanext-oaipmh-server	0.9.0
ckanext-rdkit-visuals	0.0.1
ckanext-related-resources	0.0.1
ckanext-relationship	0.1.8
ckanext-scheming	3.0.5	/usr/lib/ckan/default/src/ckanext-scheming
ckanext-search-autocomplete	0.0.1
ckanext-search-tweaks	0.3.12
ckanext-statictheme	0.0.1
ckanext-toolbelt	0.2.0
ckanext-wikidata	0.0.1
ckanserviceprovider	0.0.10
ckantoolkit	0.0.7
click	7.1.2
click-default-group	1.2.2
colorama	0.4.3
config	0.5.1
configparser	3.8.1
control	0.9.2
cookiecutter	1.7.3
coverage	5.5
coveralls	3.2.0
cryptography	41.0.5
curies	0.5.5
cycler	0.11.0
Cython	3.0.6
datapackage	1.15.2
decorator	5.0.9
distlib	0.3.2
distro	1.4.0
Django	3.2.7
docker	4.1.0
docker-compose	1.25.0
dockerpty	0.4.1
docopt	0.6.2
docutils	0.16
dominate	2.6.0
e	1.4.5
entrypoints	0.3
et-xmlfile	1.1.0
exceptiongroup	1.1.3
factory-boy	3.2.0
Faker	8.12.1
fanstatic	1.1
fasteners	0.14.1
feedgen	0.9.0
filelock	3.0.12
flake8	2.1.0
Flask	1.1.4
Flask-Babel	1.0.0
Flask-DebugToolbar	0.11.0
Flask-Login	0.5.0
flask-multistatic	1.0
fn	0.4.3
fonttools	4.38.0
freezegun	1.1.0
frictionless-ckan-mapper	1.0.7
funcsigs	1.0.2
functionally	1.0.1
future	0.18.2
geojson	3.0.1
geomet	0.3.0
greenlet	3.0.1
html5lib	1.0.1
httplib2	0.14.0
httpretty	0.9.4
idna	2.10
ijson	3.2.3
imagesize	1.2.0
importlib-metadata	4.13.0
importlib-resources	5.12.0
incremental	21.3.0
inflection	0.5.1
iniconfig	1.1.1
install	1.3.5
ipdb	0.13.7
ipython	7.27.0
iso-639	0.4.5
isodate	0.6.0
itsdangerous	1.1.0
jaraco.classes	3.2.3
jedi	0.18.0
jeepney	0.8.0
Jinja2	2.11.3
jinja2-time	0.2.0
jmespath	1.0.1
json-table-schema	0.2.1
jsonlines	3.1.0
jsonpointer	2.4
jsonschema	2.6.0
keyring	18.0.1
kiwisolver	1.4.5
launchpadlib	1.10.13
lazr.restfulclient	0.14.2
lazr.uri	1.0.3
linear-tsv	1.1.0
loader	2017.9.11
lockfile	0.12.2
losser	0.0.3
lxml	4.6.3
macaroonbakery	1.3.1
Mako	1.1.4
Markdown	3.3.4
markdown-it-py	2.2.0
MarkupSafe	2.0.1
matplotlib	3.5.3
matplotlib-inline	0.1.2
mccabe	0.6.1
mdurl	0.1.2
messytables	0.15.2
mock	1.0.1
monotonic	1.5
more-itertools	8.9.0
mypy-extensions	1.0.0
netifaces	0.10.4
nose	1.3.1
numpy	1.21.2
oauthlib	3.1.0
olefile	0.46
opencv-python	4.5.5.62
openpyxl	3.1.2
packaging	21.0
pandas	1.3.2
paramiko	2.6.0
parso	0.8.2
passlib	1.7.4
PasteDeploy	2.0.1
pathtools	0.1.2
pbr	5.4.4
pep8	1.7.1
pexpect	4.6.0
pickleshare	0.7.5
pika	1.2.0
Pillow	7.0.0
pip	24.0
pip-tools	5.1.2
pkg-resources	0.0.0
pkgutil-resolve-name	1.3.10
platformdirs	2.3.0
pluggy	0.13.1
pointfree	1.1.1
polib	1.1.1
poyo	0.5.0
prompt-toolkit	3.0.20
protobuf	3.6.1
psycopg2	2.9.1
ptyprocess	0.7.0
py	1.10.0
pycodestyle	2.5.0
pycparser	2.20
pydantic	2.5.3
pydantic-core	2.14.6
pyfakefs	3.2
pyflakes	2.4.0
Pygments	2.10.0
PyJWT	2.1.0
pymacaroons	0.13.0
PyNaCl	1.3.0
pyoai	2.5.0
pyOpenSSL	18.0.0
pyparsing	2.4.7
pyproject-hooks	1.0.0
pyRFC3339	1.1
pyrsistent	0.15.5
pysolr	3.6.0
pytest	6.2.5
pytest-ckan	0.0.12
pytest-cov	2.7.1
pytest-freezegun	0.4.2
pytest-rerunfailures	9.1.1
pytest-split-tests	1.0.9
python-dateutil	2.8.1
python-dotenv	0.21.1
python-editor	1.0.4
python-magic	0.4.24
python-slugify	1.2.4
PyTrie	0.4.0
pytz	2021.1
PyUtilib	6.0.0
pyxdg	0.26
PyYAML	5.4.1
rdflib	6.3.2
rdflib-jsonld	0.6.2
rdkit-pypi	2021.9.4
redis	3.5.3
reportlab	3.5.34
repoze.lru	0.7
repoze.who	2.3
requests	2.25.1
requests-unixsocket	0.2.0
responses	0.13.3
rfc3986	2.0.0
rich	13.7.0
Routes	1.13
rq	1.9.0
s3transfer	0.8.2
scipy	1.7.3
SecretStorage	2.3.1
setuptools	68.0.0
shapely	2.0.1
shutilwhich	1.1.0
simplejson	3.17.2
six	1.16.0
snowballstemmer	2.1.0
sortedcontainers	2.4.0
soupsieve	1.2
SPARQLWrapper	2.0.0
Sphinx	1.8.5
sphinx-rtd-theme	0.4.3
sphinxcontrib-applehelp	1.0.2
sphinxcontrib-devhelp	1.0.2
sphinxcontrib-htmlhelp	2.0.0
sphinxcontrib-jquery	4.1
sphinxcontrib-jsmath	1.0.1
sphinxcontrib-qthelp	1.0.3
sphinxcontrib-serializinghtml	1.1.5
sphinxcontrib-websupport	1.2.4
SQLAlchemy	1.3.5
sqlalchemy-migrate	0.12.0
sqlalchemy-orm	1.2.10
sqlparse	0.4.1
ssh-import-id	5.10
supervisor	4.1.0
tableschema	1.20.2
tabulate	0.9.0
tabulator	1.53.5
Tempita	0.5.2
testresources	2.0.1
text-unidecode	1.3
texttable	1.6.2
toml	0.10.2
tomli	2.0.1
towncrier	21.3.0
traitlets	5.1.0
types-PyYAML	6.0.12.12
typing-extensions	4.7.1
typing-inspect	0.9.0
tzlocal	2.1
unicodecsv	0.14.1
Unidecode	1.3.7
urllib3	1.26.6
uWSGI	2.0.19.1
virtualenv	20.7.2
wadllib	1.3.3
watchdog	2.1.3
wcwidth	0.2.5
webassets	2.0
webencodings	0.5.1
WebOb	1.8.7
websocket-client	0.53.0
Werkzeug	1.0.1
wheel	0.41.3
whichcraft	0.6.1
with	0.0.7
xlrd	2.0.1
zipp	1.2.0
zope.interface	5.4.0

Resource Usage

Resource	Value
User CPU time	46.350 msec
System CPU time	0.000 msec
Total CPU time	46.350 msec
Elapsed time	99.505 msec
Context switches	9 voluntary, 8 involuntary

HTTP Headers

Key	Value
HTTP_ACCEPT	text/html,application/xhtml+xml,application/xml;q=0.9,/;q=0.8
HTTP_ACCEPT_ENCODING	br,gzip
HTTP_ACCEPT_LANGUAGE	en-US,en;q=0.5
HTTP_CONNECTION	close
HTTP_HOST	ckanchem21.service.tib.eu
HTTP_USER_AGENT	CCBot/2.0 (https://commoncrawl.org/faq/)
QUERY_STRING	tags=adsorption&tags=covalent-organic-framework
REMOTE_ADDR	127.0.0.1
REQUEST_METHOD	GET
SCRIPT_NAME
SERVER_NAME	ckanchem21
SERVER_PORT	8080
SERVER_PROTOCOL	HTTP/1.0

Request Vars

View information

View Function	args	kwargs
ckan.views.dataset.search	[]	package_type=dataset

COOKIES Variables

Variable	Value

SESSION Variables

Variable	Value
'_domain'	None
'_path'	'/'
'_accessed_time'	1750613308.62506
'_creation_time'	1750613308.62506
'initial_search_params'	{'facet.field': ['organization', 'measurement_technique', 'tags', 'license_id'], 'fq': ['tags:"adsorption" tags:"covalent-organic-framework" +dataset_type:dataset -dataset_type:harvest', '+site_id:"default"', '+state:active', '+permission_labels:("public")'], 'q': ':', 'rows': 21, 'start': 0, 'df': 'text', 'mm': '5<-4 9<-90%', 'defType': 'edismax', 'bf': '0', 'qf': 'title^5 text', 'sort': 'score desc, metadata_modified desc', 'fl': 'id validated_data_dict', 'facet': 'true', 'facet.limit': '50', 'facet.mincount': 1, 'wt': 'json', 'tie': '0.1', 'q.op': 'AND', 'extras': {}}
'search_results_final'	{'count': 1, 'facets': {'organization': {'darus': 1}, 'measurement_technique': {}, 'tags': {'adsorption': 1, 'chemistry': 1, 'covalent-organic-framework': 1, 'density-functional-theory': 1, 'engineering': 1, 'force-fields-for-simulations': 1, 'grand-canonical-monte-carlo-simulation': 1, 'inputfiles-for-simulations': 1, 'methods-to-evaluate-and-visualize-data': 1, 'physics': 1, 'results-from-experiments': 1, 'results-from-simulations': 1, 'structural-data': 1}, 'license_id': {'': 1}}, 'results': [{'author': 'Kessler, Christopher, Schuldt, Robin, Emmerling, Sebastian, Lotsch, Bettina, Kästner, Johannes, Gross, Joachim, Hansen, Niels', 'author_email': None, 'creator_user_id': '1be646ae-ab26-47b8-8835-e4b27f11961e', 'id': 'doi-10-18419-darus-2308', 'isopen': False, 'language': 'English', 'license_id': '', 'license_title': '', 'maintainer': 'DaRUS', 'maintainer_email': None, 'metadata_created': '2023-05-08T19:13:41.625425', 'metadata_modified': '2023-05-08T19:13:41.625431', 'name': 'doi-10-18419-darus-2308', 'notes': '<p>This dataset contains results from Grand Canonical Monte Carlo (GCMC) Simulation (data/isotherms_sim/) and experiment (data/isotherms/exp). </p>\n\n<p>All Data is presented in a <a href="https://darus.uni-stuttgart.de/file.xhtml?fileId=108370">jupyter notebook</a> and for a fast overview without executing the notebook also as <a href="https://darus.uni-stuttgart.de/file.xhtml?fileId=108427">pdf-file</a>.<br>\nFurthermore the dataset contains the modified cif files of COF LZU-1, including partial charges obtained with DDEC method (data/cif/). Force field (data/forcefield/) and input files for raspa-code (data/input_files/) are also available. Results from simulations of material properties e.g. specific surface area can be found in data/material_properties/ and pore size distributions from raspa simulations are listed in data/output_psd/. The folder \'progs\' simply contains functions to make the jupyter-notebook clearer.</p>\n\nWe recommend viewing the data by choosing the option "Tree".', 'num_resources': 1, 'num_tags': 13, 'organization': {'id': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'name': 'darus', 'title': 'DaRUS', 'type': 'repository', 'description': 'Chemistry collection from DaRUS, the data repository of the University of Stuttgart.', 'image_url': 'logoDarusKreis.png', 'created': '2023-05-03T09:01:04.791551', 'is_organization': True, 'approval_status': 'approved', 'state': 'active'}, 'owner_org': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'private': False, 'related_molecule': [], 'state': 'active', 'title': "Supplementary material for 'Influence of Layer Slipping on Adsorption of Light Gases in Covalent Organic Frameworks: A Combined Experimental and Computational Study'", 'type': 'dataset', 'extras': [{'key': 'contributor', 'value': 'Kessler, Christopher'}, {'key': 'creator', 'value': 'Kessler, Christopher'}, {'key': 'date', 'value': '2021-12-17T00:00:00'}, {'key': 'identifier', 'value': 'https://doi.org/10.18419/darus-2308'}, {'key': 'metadata_modified', 'value': '2022-11-29T01:00:04'}, {'key': 'set_spec', 'value': 'all'}, {'key': 'harvest_object_id', 'value': '35322780-93c3-4f33-ae9f-707a1d44d6cc'}, {'key': 'harvest_source_id', 'value': '8ba5ef26-d024-46cd-8099-94f1e74e7a36'}, {'key': 'harvest_source_title', 'value': 'Darus Test Harvest'}], 'resources': [{'cache_last_updated': None, 'cache_url': None, 'created': '2023-05-08T19:13:41.627383', 'format': 'HTML', 'hash': '', 'id': 'a57a0a4a-700e-4a78-96b7-93e98fb0487c', 'last_modified': None, 'metadata_modified': '2023-05-08T19:13:41.609095', 'mimetype': None, 'mimetype_inner': None, 'name': "Supplementary material for 'Influence of Layer Slipping on Adsorption of Light Gases in Covalent Organic Frameworks: A Combined Experimental and Computational Study'", 'package_id': 'doi-10-18419-darus-2308', 'position': 0, 'resource_type': 'HTML', 'size': None, 'state': 'active', 'url': 'https://doi.org/10.18419/darus-2308', 'url_type': None}], 'tags': [{'display_name': 'adsorption', 'id': '93d0d375-e7a2-476a-b7b9-8bb74b45107b', 'name': 'adsorption', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'chemistry', 'id': '20e4e978-2a22-4286-a18b-4ae22d1ffca1', 'name': 'chemistry', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'covalent-organic-framework', 'id': '5a6dcae2-b0ae-424e-84a4-f3c428400320', 'name': 'covalent-organic-framework', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'density-functional-theory', 'id': '05ed3b04-b36f-438a-9fb9-739fe4c6e183', 'name': 'density-functional-theory', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'engineering', 'id': '3ff6cbc9-08ad-4fd1-aa1e-6676db9d1e1c', 'name': 'engineering', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'force-fields-for-simulations', 'id': '4127b176-3908-47f0-b018-1861790956a6', 'name': 'force-fields-for-simulations', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'grand-canonical-monte-carlo-simulation', 'id': '312b8f2d-978e-49eb-9bb6-5e435696f384', 'name': 'grand-canonical-monte-carlo-simulation', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'inputfiles-for-simulations', 'id': 'b7fb12e0-1221-4ee4-bacd-eebc04650b08', 'name': 'inputfiles-for-simulations', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'methods-to-evaluate-and-visualize-data', 'id': 'ae54652d-f61a-4fa7-9960-dd04217de1a8', 'name': 'methods-to-evaluate-and-visualize-data', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'physics', 'id': '820fb04d-8f9c-45ca-9a54-9054d91e527b', 'name': 'physics', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'results-from-experiments', 'id': 'fbfedacb-831e-4483-9d0f-79269d692da1', 'name': 'results-from-experiments', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'results-from-simulations', 'id': '39bd9f6d-8659-4ce9-89d9-873c7c72c2e3', 'name': 'results-from-simulations', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'structural-data', 'id': '4239c14f-9bda-4422-8daa-7c43ad2b0505', 'name': 'structural-data', 'state': 'active', 'vocabulary_id': None}], 'groups': [], 'relationships_as_subject': [], 'relationships_as_object': []}], 'sort': 'score desc, metadata_modified desc', 'search_facets': {'organization': {'title': 'organization', 'items': [{'name': 'darus', 'display_name': 'DaRUS', 'count': 1}]}, 'measurement_technique': {'title': 'measurement_technique', 'items': []}, 'tags': {'title': 'tags', 'items': [{'name': 'structural-data', 'display_name': 'structural-data', 'count': 1}, {'name': 'results-from-simulations', 'display_name': 'results-from-simulations', 'count': 1}, {'name': 'results-from-experiments', 'display_name': 'results-from-experiments', 'count': 1}, {'name': 'physics', 'display_name': 'physics', 'count': 1}, {'name': 'methods-to-evaluate-and-visualize-data', 'display_name': 'methods-to-evaluate-and-visualize-data', 'count': 1}, {'name': 'inputfiles-for-simulations', 'display_name': 'inputfiles-for-simulations', 'count': 1}, {'name': 'grand-canonical-monte-carlo-simulation', 'display_name': 'grand-canonical-monte-carlo-simulation', 'count': 1}, {'name': 'force-fields-for-simulations', 'display_name': 'force-fields-for-simulations', 'count': 1}, {'name': 'engineering', 'display_name': 'engineering', 'count': 1}, {'name': 'density-functional-theory', 'display_name': 'density-functional-theory', 'count': 1}, {'name': 'covalent-organic-framework', 'display_name': 'covalent-organic-framework', 'count': 1}, {'name': 'chemistry', 'display_name': 'chemistry', 'count': 1}, {'name': 'adsorption', 'display_name': 'adsorption', 'count': 1}]}, 'license_id': {'title': 'license_id', 'items': [{'name': '', 'display_name': '', 'count': 1}]}}}
'search_params'	None

GET Variables

Variable	Value
'tags'	'adsorption', 'covalent-organic-framework'

POST Variables

Variable	Value

Config

Key	Value
__file__	`'/etc/ckan/default/ckan.ini'`
api_token.jwt.algorithm	`'HS256'`
api_token.jwt.decode.secret	`'string:PM7zBwMqfTXsLug_o5kv3Da-4'`
api_token.jwt.encode.secret	`'string:PM7zBwMqfTXsLug_o5kv3Da-4'`
api_token.nbytes	`'60'`
app_instance_uuid	`'0a350d0f-e185-4c12-8d88-365e441891de'`
APPLICATION_ROOT	`'/'`
BABEL_DEFAULT_LOCALE	`'en'`
BABEL_DEFAULT_TIMEZONE	`'Europe/Berlin'`
BABEL_DOMAIN	`'ckan'`
BABEL_MULTIPLE_DOMAINS	`'ckan;ckanext-harvest;ckanext-dcat'`
BABEL_TRANSLATION_DIRECTORIES	`'/usr/lib/ckan/default/lib/python3.7/site-packages/ckan/i18n;/usr/lib/ckan/default/src/ckanext-harvest/ckanext/harvest/i18n;/usr/lib/ckan/default/src/ckanext-dcat/ckanext/dcat/plugins/../i18n'`
beaker.session.key	`'ckan'`
beaker.session.secret	`'PM7zBwMqfTXsLug_o5kv3Da-4'`
cache_dir	`'/tmp/default/'`
ckan.auth.allow_dataset_collaborators	`'false'`
ckan.auth.anon_create_dataset	`'false'`
ckan.auth.create_dataset_if_not_in_organization	`'false'`
ckan.auth.create_default_api_keys	`'false'`
ckan.auth.create_unowned_dataset	`'true'`
ckan.auth.create_user_via_api	`'false'`
ckan.auth.create_user_via_web	`'false'`
ckan.auth.public_activity_stream_detail	`'false'`
ckan.auth.public_user_details	`'false'`
ckan.auth.roles_that_cascade_to_sub_groups	`'admin'`
ckan.auth.user_create_groups	`'false'`
ckan.auth.user_create_organizations	`'false'`
ckan.auth.user_delete_groups	`'false'`
ckan.auth.user_delete_organizations	`'false'`
ckan.base_public_folder	`'public'`
ckan.base_templates_folder	`'templates'`
ckan.datapusher.formats	`'csv xls xlsx tsv application/csv application/vnd.ms-excel application/vnd.openxmlformats-officedocument.spreadsheetml.sheet'`
ckan.datapusher.url	`'http://127.0.0.1:8800/'`
ckan.datastore.default_fts_index_method	`'gist'`
ckan.datastore.default_fts_lang	`'english'`
ckan.datastore.read_url	`'postgresql://datastore_default:zxcvbnm,.@localhost/datastore_default'`
ckan.datastore.write_url	`'postgresql://ckan_default:123456789@localhost/datastore_default'`
ckan.devserver.host	`'0.0.0.0'`
ckan.devserver.port	`'8080'`
ckan.display_timezone	`'server'`
ckan.favicon	`'/base/images/N4C_icon.png'`
ckan.feeds.author_link	`''`
ckan.feeds.author_name	`''`
ckan.feeds.authority_name	`''`
ckan.feeds.date	`''`
ckan.gravatar_default	`'identicon'`
ckan.harvest.mq.type	`'redis'`
ckan.hide_activity_from_users	`'default'`
ckan.homepage_style	`''`
ckan.host	`'search.nfdi4chem.de'`
ckan.jobs.timeout	`'180'`
ckan.locale_default	`'en'`
ckan.locale_order	`'en pt_BR ja it cs_CZ ca es fr el sv sr sr@latin no sk fi ru de pl nl bg ko_KR hu sa sl lv'`
ckan.locales_filtered_out	`'en_GB'`
ckan.locales_offered	`''`
ckan.main_css	`'/base/css/main.css'`
ckan.max_image_size	`'2'`
ckan.max_resource_size	`'10'`
ckan.plugins	`'resource_proxy statictheme dcat composite_search default_composite_search search_tweaks search_tweaks_query_relevance search_tweaks_field_relevance search_tweaks_spellcheck search_tweaks_advanced_search search_autocomplete footer scheming_organizations scheming_nerf_index scheming_datasets relationship structured_data harvest ckan_harvester rdkit_visuals related_resources bioschemaharvester nmrxivharvester chemotionharvester oaipmh_harvester oaipmh_dc_harvester dataverse_harvester'`
ckan.preview.direct	`'png jpg gif'`
ckan.preview.loadable	`'html htm rdf+xml owl+xml xml n3 n-triples turtle plain atom csv tsv rss txt json'`
ckan.search.rows_max	`'10000'`
ckan.search.show_all_types	`'dataset molecule'`
ckan.site_about	`''`
ckan.site_custom_css	`''`
ckan.site_description	`''`
ckan.site_id	`'default'`
ckan.site_intro_text	`'<p> NFDI4Chem is an initiative to build an open and FAIR infrastructure for research data management in chemistry. This Search Service provides overarching datasets and search results from various chemistry repositories. <p>'`
ckan.site_logo	`'/base/images/ckan-logo.png'`
ckan.site_title	`'NFDI4Chem Search Service'`
ckan.site_url	`'https://search.nfdi4chem.de'`
ckan.storage_path	`'/var/lib/ckan/default'`
ckan.theme	`''`
ckan.tracking_enabled	`'true'`
ckan.views.default_views	`'image_view text_view recline_view'`
ckanext.dcat.datasets_per_page	`'1000'`
ckanext.dcat.rdf.profiles	`'euro_dcat_ap schemaorg'`
ckanext.search_autocomplete.autocomplete_limit	`'10'`
ckanext.search_autocomplete.dataset_search_endpoints	`'dataset.search molecule.search'`
ckanext.search_autocomplete.enable_default_implementation	`'yes'`
ckanext.search_tweaks.common.fuzzy_search.distance	`'2'`
ckanext.search_tweaks.common.fuzzy_search.enabled	`'on'`
ckanext.search_tweaks.common.mm	`'5<-4 9<-90%'`
ckanext.search_tweaks.common.prefer_boost	`'no'`
ckanext.search_tweaks.common.qf	`'title^5 text'`
ckanext.search_tweaks.query_relevance.boost_function	`'recip($field,1,1000,1000)'`
ckanext.search_tweaks.query_relevance.daily.age	`'90'`
ckanext.search_tweaks.query_relevance.field_prefix	`'query_relevance_'`
ckanext.search_tweaks.spellcheck.max_suggestions	`'3'`
ckanext.search_tweaks.spellcheck.more_results_only	`'off'`
clear_logo_upload	`''`
computed_template_paths	['/usr/lib/ckan/default/src/ckanext-statictheme/ckanext/statictheme/templates', '/usr/lib/ckan/default/src/ckanext-dcat/ckanext/dcat/plugins/../templates', '/usr/lib/ckan/default/lib/python3.7/site-packages/ckanext/search_tweaks/field_relevance/templates', '/usr/lib/ckan/default/lib/python3.7/site-packages/ckanext/search_tweaks/spellcheck/templates', '/usr/lib/ckan/default/lib/python3.7/site-packages/ckanext/search_tweaks/advanced_search/templates', '/usr/lib/ckan/default/src/ckanext-search-autocomplete/ckanext/search_autocomplete/templates', '/usr/lib/ckan/default/src/ckanext-footer/ckanext/footer/templates', '/usr/lib/ckan/default/src/ckanext-scheming/ckanext/scheming/templates', '/usr/lib/ckan/default/src/ckanext-relationship/ckanext/relationship/templates', '/usr/lib/ckan/default/src/ckanext-harvest/ckanext/harvest/templates', '/usr/lib/ckan/default/src/ckanext-rdkit-visuals/ckanext/rdkit_visuals/templates', '/usr/lib/ckan/default/src/ckanext-related_resources/ckanext/related_resources/templates', '/usr/lib/ckan/default/lib/python3.7/site-packages/ckan/templates']
DEBUG	`True`
debug	`'true'`
DEBUG_TB_ENABLED	`True`
DEBUG_TB_HOSTS	`()`
DEBUG_TB_INTERCEPT_REDIRECTS	`False`
DEBUG_TB_PANELS	('flask_debugtoolbar.panels.versions.VersionDebugPanel', 'flask_debugtoolbar.panels.timer.TimerDebugPanel', 'flask_debugtoolbar.panels.headers.HeaderDebugPanel', 'flask_debugtoolbar.panels.request_vars.RequestVarsDebugPanel', 'flask_debugtoolbar.panels.config_vars.ConfigVarsDebugPanel', 'flask_debugtoolbar.panels.template.TemplateDebugPanel', 'flask_debugtoolbar.panels.sqlalchemy.SQLAlchemyDebugPanel', 'flask_debugtoolbar.panels.logger.LoggingPanel', 'flask_debugtoolbar.panels.route_list.RouteListDebugPanel', 'flask_debugtoolbar.panels.profiler.ProfilerDebugPanel')
ENV	`'production'`
expire_api_token.default_lifetime	`'3600'`
EXPLAIN_TEMPLATE_LOADING	`False`
extra_public_paths	'/usr/lib/ckan/default/src/ckanext-statictheme/ckanext/statictheme/public,/usr/lib/ckan/default/src/ckanext-search-autocomplete/ckanext/search_autocomplete/public,/usr/lib/ckan/default/src/ckanext-footer/ckanext/footer/public,/usr/lib/ckan/default/src/ckanext-relationship/ckanext/relationship/public,/usr/lib/ckan/default/src/ckanext-harvest/ckanext/harvest/public,/usr/lib/ckan/default/src/ckanext-rdkit-visuals/ckanext/rdkit_visuals/public,/usr/lib/ckan/default/src/ckanext-related_resources/ckanext/related_resources/public'
extra_template_paths	'/usr/lib/ckan/default/src/ckanext-statictheme/ckanext/statictheme/templates,/usr/lib/ckan/default/src/ckanext-dcat/ckanext/dcat/plugins/../templates,/usr/lib/ckan/default/lib/python3.7/site-packages/ckanext/search_tweaks/field_relevance/templates,/usr/lib/ckan/default/lib/python3.7/site-packages/ckanext/search_tweaks/spellcheck/templates,/usr/lib/ckan/default/lib/python3.7/site-packages/ckanext/search_tweaks/advanced_search/templates,/usr/lib/ckan/default/src/ckanext-search-autocomplete/ckanext/search_autocomplete/templates,/usr/lib/ckan/default/src/ckanext-footer/ckanext/footer/templates,/usr/lib/ckan/default/src/ckanext-scheming/ckanext/scheming/templates,/usr/lib/ckan/default/src/ckanext-relationship/ckanext/relationship/templates,/usr/lib/ckan/default/src/ckanext-harvest/ckanext/harvest/templates,/usr/lib/ckan/default/src/ckanext-rdkit-visuals/ckanext/rdkit_visuals/templates,/usr/lib/ckan/default/src/ckanext-related_resources/ckanext/related_resources/templates'
global_conf	`OrderedDict([('__file__', '/etc/ckan/default/ckan.ini'), ('here', '/etc/ckan/default'), ('debug', 'true')])`
here	`'/etc/ckan/default'`
JSON_AS_ASCII	`True`
JSON_SORT_KEYS	`True`
JSONIFY_MIMETYPE	`'application/json'`
JSONIFY_PRETTYPRINT_REGULAR	`False`
licenses_group_url	`'file:///etc/ckan/default/license/licenses.json'`
logo_upload	`''`
MAX_CONTENT_LENGTH	`None`
MAX_COOKIE_SIZE	`4093`
PERMANENT_SESSION_LIFETIME	`datetime.timedelta(days=31)`
PREFERRED_URL_SCHEME	`'http'`
PRESERVE_CONTEXT_ON_EXCEPTION	`None`
PROPAGATE_EXCEPTIONS	`None`
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'package_list_for_every_inchi': <function FooterController.package_show_dict at 0x7f0d18e7c048>, 'get_molecule_data': <function FooterController.get_molecule_data at 0x7f0d18e7be18>, 'package_list': <function FooterPlugin.molecule_view_search at 0x7f0d18e7c8c8>, 'search_autocomplete_enable_default_implementation': <function enable_default_implementation at 0x7f0d18da0d90>, 'advanced_search_form_config': <function form_config at 0x7f0d18d986a8>, 'advanced_search_form_config_image': <function form_config_image at 0x7f0d18da0378>, 'spellcheck_did_you_mean': <function spellcheck_did_you_mean at 0x7f0d18d98ae8>, 'composite_search_get_prefix': <function get_prefix at 0x7f0d18ec5b70>, 'helper_available': <function helper_available at 0x7f0d19211268>, 'dcat_get_endpoint': <function get_endpoint at 0x7f0d19211ae8>, 'dcat_endpoints_enabled': <function endpoints_enabled at 0x7f0d19211a60>, 'repositories_dataset_present_count': <function repositories_dataset_present_count at 0x7f0d192a06a8>, 'get_measurement_count': <function get_measurement_count at 0x7f0d192a0730>}
scheming.dataset_schemas	`'ckanext.scheming:bioschema4Chem/dataset4chem.yaml\nckanext.scheming:bioschema4Chem/fancy_type.yaml\nckanext.scheming:bioschema4Chem/molecule4chem.yaml\nckanext.scheming:ckan_dataset.yaml'`
scheming.organization_schemas	`'ckanext.scheming:custom_org_with_address.json'`
SECRET_KEY	`'PM7zBwMqfTXsLug_o5kv3Da-4'`
SEND_FILE_MAX_AGE_DEFAULT	`datetime.timedelta(seconds=43200)`
SERVER_NAME	`None`
SESSION_COOKIE_DOMAIN	`None`
SESSION_COOKIE_HTTPONLY	`True`
SESSION_COOKIE_NAME	`'session'`
SESSION_COOKIE_PATH	`None`
SESSION_COOKIE_SAMESITE	`None`
SESSION_COOKIE_SECURE	`False`
SESSION_REFRESH_EACH_REQUEST	`True`
solr_timeout	`'120'`
solr_url	`'http://127.0.0.1:8983/solr/ckan'`
sqlalchemy.pool_pre_ping	`True`
sqlalchemy.url	`'postgresql://ckan_default:123456789@localhost/ckan_default'`
TEMPLATES_AUTO_RELOAD	`None`
TESTING	`False`
TRAP_BAD_REQUEST_ERRORS	`None`
TRAP_HTTP_EXCEPTIONS	`False`
use	`'egg:ckan'`
USE_X_SENDFILE	`False`
who.config_file	`'/etc/ckan/default/who.ini'`
who.log_file	`'/tmp/default//who_log.ini'`
who.log_level	`'warning'`

Templates

snippets/statictheme_css.html

Variable	Value
c	<flask.g of 'ckan.config.middleware.flask_app'>
g	<flask.g of 'ckan.config.middleware.flask_app'>
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<function scheming_datastore_choices at 0x7f0d19014268>, 'scheming_field_required': <function scheming_field_required at 0x7f0d190142f0>, 'scheming_dataset_schemas': <function scheming_dataset_schemas at 0x7f0d19014378>, 'scheming_get_presets': <function scheming_get_presets at 0x7f0d19014400>, 'scheming_get_preset': <function scheming_get_preset at 0x7f0d19014488>, 'scheming_get_dataset_schema': <function scheming_get_dataset_schema at 0x7f0d19014510>, 'scheming_get_dataset_form_pages': <function scheming_get_dataset_form_pages at 0x7f0d19014598>, 'scheming_group_schemas': <function scheming_group_schemas at 0x7f0d19014620>, 'scheming_get_group_schema': <function scheming_get_group_schema at 0x7f0d190146a8>, 'scheming_organization_schemas': <function scheming_organization_schemas at 0x7f0d19014730>, 'scheming_get_organization_schema': <function scheming_get_organization_schema at 0x7f0d190147b8>, 'scheming_get_schema': <function scheming_get_schema at 0x7f0d19014840>, 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request	<Request 'https://ckanchem21.service.tib.eu/dataset/?tags=adsorption&tags=covalent-organic-framework' [GET]>
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Force field (data/forcefield/) and input files for raspa-code (data/input_files/) are also available. Results from simulations of material properties e.g. specific surface area can be found in data/material_properties/ and pore size distributions from raspa simulations are listed in data/output_psd/. 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Force field (data/forcefield/) and input files for raspa-code (data/input_files/) are also available. Results from simulations of material properties e.g. specific surface area can be found in data/material_properties/ and pore size distributions from raspa simulations are listed in data/output_psd/. The folder \'progs\' simply contains functions to make the jupyter-notebook clearer.</p>\n\nWe recommend viewing the data by choosing the option "Tree".', 'num_resources': 1, 'num_tags': 13, 'organization': {'id': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'name': 'darus', 'title': 'DaRUS', 'type': 'repository', 'description': 'Chemistry collection from DaRUS, the data repository of the University of Stuttgart.', 'image_url': 'logoDarusKreis.png', 'created': '2023-05-03T09:01:04.791551', 'is_organization': True, 'approval_status': 'approved', 'state': 'active'}, 'owner_org': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'private': False, 'related_molecule': [], 'state': 'active', 'title': "Supplementary material for 'Influence of Layer Slipping on Adsorption of Light Gases in Covalent Organic Frameworks: A Combined Experimental and Computational Study'", 'type': 'dataset', 'extras': [{'key': 'contributor', 'value': 'Kessler, Christopher'}, {'key': 'creator', 'value': 'Kessler, Christopher'}, 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Force field (data/forcefield/) and input files for raspa-code (data/input_files/) are also available. Results from simulations of material properties e.g. specific surface area can be found in data/material_properties/ and pore size distributions from raspa simulations are listed in data/output_psd/. 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Force field (data/forcefield/) and input files for raspa-code (data/input_files/) are also available. Results from simulations of material properties e.g. specific surface area can be found in data/material_properties/ and pore size distributions from raspa simulations are listed in data/output_psd/. The folder \'progs\' simply contains functions to make the jupyter-notebook clearer.</p>\n\nWe recommend viewing the data by choosing the option "Tree".', 'num_resources': 1, 'num_tags': 13, 'organization': {'id': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'name': 'darus', 'title': 'DaRUS', 'type': 'repository', 'description': 'Chemistry collection from DaRUS, the data repository of the University of Stuttgart.', 'image_url': 'logoDarusKreis.png', 'created': '2023-05-03T09:01:04.791551', 'is_organization': True, 'approval_status': 'approved', 'state': 'active'}, 'owner_org': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'private': False, 'related_molecule': [], 'state': 'active', 'title': "Supplementary material for 'Influence of Layer Slipping on Adsorption of Light Gases in Covalent Organic Frameworks: A Combined Experimental and Computational Study'", 'type': 'dataset', 'extras': [{'key': 'contributor', 'value': 'Kessler, Christopher'}, {'key': 'creator', 'value': 'Kessler, Christopher'}, 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Force field (data/forcefield/) and input files for raspa-code (data/input_files/) are also available. Results from simulations of material properties e.g. specific surface area can be found in data/material_properties/ and pore size distributions from raspa simulations are listed in data/output_psd/. 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Force field (data/forcefield/) and input files for raspa-code (data/input_files/) are also available. Results from simulations of material properties e.g. specific surface area can be found in data/material_properties/ and pore size distributions from raspa simulations are listed in data/output_psd/. The folder \'progs\' simply contains functions to make the jupyter-notebook clearer.</p>\n\nWe recommend viewing the data by choosing the option "Tree".', 'num_resources': 1, 'num_tags': 13, 'organization': {'id': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'name': 'darus', 'title': 'DaRUS', 'type': 'repository', 'description': 'Chemistry collection from DaRUS, the data repository of the University of Stuttgart.', 'image_url': 'logoDarusKreis.png', 'created': '2023-05-03T09:01:04.791551', 'is_organization': True, 'approval_status': 'approved', 'state': 'active'}, 'owner_org': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'private': False, 'related_molecule': [], 'state': 'active', 'title': "Supplementary material for 'Influence of Layer Slipping on Adsorption of Light Gases in Covalent Organic Frameworks: A Combined Experimental and Computational Study'", 'type': 'dataset', 'extras': [{'key': 'contributor', 'value': 'Kessler, Christopher'}, {'key': 'creator', 'value': 'Kessler, Christopher'}, 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package	{'author': 'Kessler, Christopher, Schuldt, Robin, Emmerling, Sebastian, Lotsch, Bettina, Kästner, Johannes, Gross, Joachim, Hansen, Niels', 'author_email': None, 'creator_user_id': '1be646ae-ab26-47b8-8835-e4b27f11961e', 'id': 'doi-10-18419-darus-2308', 'isopen': False, 'language': 'English', 'license_id': '', 'license_title': '', 'maintainer': 'DaRUS', 'maintainer_email': None, 'metadata_created': '2023-05-08T19:13:41.625425', 'metadata_modified': '2023-05-08T19:13:41.625431', 'name': 'doi-10-18419-darus-2308', 'notes': '<p>This dataset contains results from Grand Canonical Monte Carlo (GCMC) Simulation (data/isotherms_sim/) and experiment (data/isotherms/exp). </p>\n\n<p>All Data is presented in a <a href="https://darus.uni-stuttgart.de/file.xhtml?fileId=108370">jupyter notebook</a> and for a fast overview without executing the notebook also as <a href="https://darus.uni-stuttgart.de/file.xhtml?fileId=108427">pdf-file</a>.<br>\nFurthermore the dataset contains the modified cif files of COF LZU-1, including partial charges obtained with DDEC method (data/cif/). Force field (data/forcefield/) and input files for raspa-code (data/input_files/) are also available. Results from simulations of material properties e.g. specific surface area can be found in data/material_properties/ and pore size distributions from raspa simulations are listed in data/output_psd/. The folder \'progs\' simply contains functions to make the jupyter-notebook clearer.</p>\n\nWe recommend viewing the data by choosing the option "Tree".', 'num_resources': 1, 'num_tags': 13, 'organization': {'id': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'name': 'darus', 'title': 'DaRUS', 'type': 'repository', 'description': 'Chemistry collection from DaRUS, the data repository of the University of Stuttgart.', 'image_url': 'logoDarusKreis.png', 'created': '2023-05-03T09:01:04.791551', 'is_organization': True, 'approval_status': 'approved', 'state': 'active'}, 'owner_org': '9a7d2a53-21f6-412a-afb9-a15122df0640', 'private': False, 'related_molecule': [], 'state': 'active', 'title': "Supplementary material for 'Influence of Layer Slipping on Adsorption of Light Gases in Covalent Organic Frameworks: A Combined Experimental and Computational Study'", 'type': 'dataset', 'extras': [{'key': 'contributor', 'value': 'Kessler, Christopher'}, {'key': 'creator', 'value': 'Kessler, Christopher'}, {'key': 'date', 'value': '2021-12-17T00:00:00'}, {'key': 'identifier', 'value': 'https://doi.org/10.18419/darus-2308'}, {'key': 'metadata_modified', 'value': '2022-11-29T01:00:04'}, {'key': 'set_spec', 'value': 'all'}, {'key': 'harvest_object_id', 'value': '35322780-93c3-4f33-ae9f-707a1d44d6cc'}, {'key': 'harvest_source_id', 'value': '8ba5ef26-d024-46cd-8099-94f1e74e7a36'}, {'key': 'harvest_source_title', 'value': 'Darus Test Harvest'}], 'resources': [{'cache_last_updated': None, 'cache_url': None, 'created': '2023-05-08T19:13:41.627383', 'format': 'HTML', 'hash': '', 'id': 'a57a0a4a-700e-4a78-96b7-93e98fb0487c', 'last_modified': None, 'metadata_modified': '2023-05-08T19:13:41.609095', 'mimetype': None, 'mimetype_inner': None, 'name': "Supplementary material for 'Influence of Layer Slipping on Adsorption of Light Gases in Covalent Organic Frameworks: A Combined Experimental and Computational Study'", 'package_id': 'doi-10-18419-darus-2308', 'position': 0, 'resource_type': 'HTML', 'size': None, 'state': 'active', 'url': 'https://doi.org/10.18419/darus-2308', 'url_type': None}], 'tags': [{'display_name': 'adsorption', 'id': '93d0d375-e7a2-476a-b7b9-8bb74b45107b', 'name': 'adsorption', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'chemistry', 'id': '20e4e978-2a22-4286-a18b-4ae22d1ffca1', 'name': 'chemistry', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'covalent-organic-framework', 'id': '5a6dcae2-b0ae-424e-84a4-f3c428400320', 'name': 'covalent-organic-framework', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'density-functional-theory', 'id': '05ed3b04-b36f-438a-9fb9-739fe4c6e183', 'name': 'density-functional-theory', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'engineering', 'id': '3ff6cbc9-08ad-4fd1-aa1e-6676db9d1e1c', 'name': 'engineering', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'force-fields-for-simulations', 'id': '4127b176-3908-47f0-b018-1861790956a6', 'name': 'force-fields-for-simulations', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'grand-canonical-monte-carlo-simulation', 'id': '312b8f2d-978e-49eb-9bb6-5e435696f384', 'name': 'grand-canonical-monte-carlo-simulation', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'inputfiles-for-simulations', 'id': 'b7fb12e0-1221-4ee4-bacd-eebc04650b08', 'name': 'inputfiles-for-simulations', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'methods-to-evaluate-and-visualize-data', 'id': 'ae54652d-f61a-4fa7-9960-dd04217de1a8', 'name': 'methods-to-evaluate-and-visualize-data', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'physics', 'id': '820fb04d-8f9c-45ca-9a54-9054d91e527b', 'name': 'physics', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'results-from-experiments', 'id': 'fbfedacb-831e-4483-9d0f-79269d692da1', 'name': 'results-from-experiments', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'results-from-simulations', 'id': '39bd9f6d-8659-4ce9-89d9-873c7c72c2e3', 'name': 'results-from-simulations', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'structural-data', 'id': '4239c14f-9bda-4422-8daa-7c43ad2b0505', 'name': 'structural-data', 'state': 'active', 'vocabulary_id': None}], 'groups': [], 'relationships_as_subject': [], 'relationships_as_object': []}
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{'key': 'date', 'value': '2021-12-17T00:00:00'}, {'key': 'identifier', 'value': 'https://doi.org/10.18419/darus-2308'}, {'key': 'metadata_modified', 'value': '2022-11-29T01:00:04'}, {'key': 'set_spec', 'value': 'all'}, {'key': 'harvest_object_id', 'value': '35322780-93c3-4f33-ae9f-707a1d44d6cc'}, {'key': 'harvest_source_id', 'value': '8ba5ef26-d024-46cd-8099-94f1e74e7a36'}, {'key': 'harvest_source_title', 'value': 'Darus Test Harvest'}], 'resources': [{'cache_last_updated': None, 'cache_url': None, 'created': '2023-05-08T19:13:41.627383', 'format': 'HTML', 'hash': '', 'id': 'a57a0a4a-700e-4a78-96b7-93e98fb0487c', 'last_modified': None, 'metadata_modified': '2023-05-08T19:13:41.609095', 'mimetype': None, 'mimetype_inner': None, 'name': "Supplementary material for 'Influence of Layer Slipping on Adsorption of Light Gases in Covalent Organic Frameworks: A Combined Experimental and Computational Study'", 'package_id': 'doi-10-18419-darus-2308', 'position': 0, 'resource_type': 'HTML', 'size': None, 'state': 'active', 'url': 'https://doi.org/10.18419/darus-2308', 'url_type': None}], 'tags': [{'display_name': 'adsorption', 'id': '93d0d375-e7a2-476a-b7b9-8bb74b45107b', 'name': 'adsorption', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'chemistry', 'id': '20e4e978-2a22-4286-a18b-4ae22d1ffca1', 'name': 'chemistry', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'covalent-organic-framework', 'id': '5a6dcae2-b0ae-424e-84a4-f3c428400320', 'name': 'covalent-organic-framework', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'density-functional-theory', 'id': '05ed3b04-b36f-438a-9fb9-739fe4c6e183', 'name': 'density-functional-theory', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'engineering', 'id': '3ff6cbc9-08ad-4fd1-aa1e-6676db9d1e1c', 'name': 'engineering', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'force-fields-for-simulations', 'id': '4127b176-3908-47f0-b018-1861790956a6', 'name': 'force-fields-for-simulations', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'grand-canonical-monte-carlo-simulation', 'id': '312b8f2d-978e-49eb-9bb6-5e435696f384', 'name': 'grand-canonical-monte-carlo-simulation', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'inputfiles-for-simulations', 'id': 'b7fb12e0-1221-4ee4-bacd-eebc04650b08', 'name': 'inputfiles-for-simulations', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'methods-to-evaluate-and-visualize-data', 'id': 'ae54652d-f61a-4fa7-9960-dd04217de1a8', 'name': 'methods-to-evaluate-and-visualize-data', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'physics', 'id': '820fb04d-8f9c-45ca-9a54-9054d91e527b', 'name': 'physics', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'results-from-experiments', 'id': 'fbfedacb-831e-4483-9d0f-79269d692da1', 'name': 'results-from-experiments', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'results-from-simulations', 'id': '39bd9f6d-8659-4ce9-89d9-873c7c72c2e3', 'name': 'results-from-simulations', 'state': 'active', 'vocabulary_id': None}, {'display_name': 'structural-data', 'id': '4239c14f-9bda-4422-8daa-7c43ad2b0505', 'name': 'structural-data', 'state': 'active', 'vocabulary_id': None}], 'groups': [], 'relationships_as_subject': [], 'relationships_as_object': []}], 'sort': 'score desc, metadata_modified desc', 'search_facets': {'organization': {'title': 'organization', 'items': [{'name': 'darus', 'display_name': 'DaRUS', 'count': 1}]}, 'measurement_technique': {'title': 'measurement_technique', 'items': []}, 'tags': {'title': 'tags', 'items': [{'name': 'structural-data', 'display_name': 'structural-data', 'count': 1}, {'name': 'results-from-simulations', 'display_name': 'results-from-simulations', 'count': 1}, {'name': 'results-from-experiments', 'display_name': 'results-from-experiments', 'count': 1}, {'name': 'physics', 'display_name': 'physics', 'count': 1}, {'name': 'methods-to-evaluate-and-visualize-data', 'display_name': 'methods-to-evaluate-and-visualize-data', 'count': 1}, {'name': 'inputfiles-for-simulations', 'display_name': 'inputfiles-for-simulations', 'count': 1}, {'name': 'grand-canonical-monte-carlo-simulation', 'display_name': 'grand-canonical-monte-carlo-simulation', 'count': 1}, {'name': 'force-fields-for-simulations', 'display_name': 'force-fields-for-simulations', 'count': 1}, {'name': 'engineering', 'display_name': 'engineering', 'count': 1}, {'name': 'density-functional-theory', 'display_name': 'density-functional-theory', 'count': 1}, {'name': 'covalent-organic-framework', 'display_name': 'covalent-organic-framework', 'count': 1}, {'name': 'chemistry', 'display_name': 'chemistry', 'count': 1}, {'name': 'adsorption', 'display_name': 'adsorption', 'count': 1}]}, 'license_id': {'title': 'license_id', 'items': [{'name': '', 'display_name': '', 'count': 1}]}}}, 'search_params': None}
sort_by	functools.partial(<function _sort_by at 0x7f0d1920a1e0>, [('tags', 'adsorption'), ('tags', 'covalent-organic-framework')], 'dataset')
sort_by_fields	[]
sort_by_selected	'score desc, metadata_modified desc'
ungettext	<function ungettext at 0x7f0d1e2eb1e0>

SQLAlchemy queries

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Install required libraries:
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Route List

URL route	Endpoint name	HTTP methods	Is alias	Redirect to
/	home.index	GET, HEAD, OPTIONS	False	None
/<path:filename>	static	GET, HEAD, OPTIONS	False	None
/about	home.about	GET, HEAD, OPTIONS	False	None
/api/	api.get_api	GET, HEAD, OPTIONS	False	None
/api/2/util/relationships/autocomplete	relationships.relationships_autocomplete	GET, HEAD, OPTIONS	False	None
/api/<int(min=1, max=2):ver>/i18n/<lang>	api.i18n_js_translations	GET, HEAD, OPTIONS	False	None
/api/<int(min=1, max=2):ver>/util/dataset/autocomplete	api.dataset_autocomplete	GET, HEAD, OPTIONS	False	None
/api/<int(min=1, max=2):ver>/util/group/autocomplete	api.group_autocomplete	GET, HEAD, OPTIONS	False	None
/api/<int(min=1, max=2):ver>/util/organization/autocomplete	api.organization_autocomplete	GET, HEAD, OPTIONS	False	None
/api/<int(min=1, max=2):ver>/util/resource/format_autocomplete	api.format_autocomplete	GET, HEAD, OPTIONS	False	None
/api/<int(min=1, max=2):ver>/util/snippet/<snippet_path>	api.snippet	GET, HEAD, OPTIONS	False	None
/api/<int(min=1, max=2):ver>/util/tag/autocomplete	api.tag_autocomplete	GET, HEAD, OPTIONS	False	None
/api/<int(min=1, max=2):ver>/util/user/autocomplete	api.user_autocomplete	GET, HEAD, OPTIONS	False	None
/api/<int(min=1, max=3):ver>	api.get_api	GET, HEAD, OPTIONS	False	None
/api/<int(min=3, max=3):ver>/action/<logic_function>	api.action	GET, HEAD, OPTIONS, POST	False	None
/api/action/<logic_function>	api.action	GET, HEAD, OPTIONS, POST	False	None
/api/i18n/<lang>	api.i18n_js_translations	GET, HEAD, OPTIONS	False	None
/api/util/dataset/autocomplete	api.dataset_autocomplete	GET, HEAD, OPTIONS	False	None
/api/util/group/autocomplete	api.group_autocomplete	GET, HEAD, OPTIONS	False	None
/api/util/organization/autocomplete	api.organization_autocomplete	GET, HEAD, OPTIONS	False	None
/api/util/resource/format_autocomplete	api.format_autocomplete	GET, HEAD, OPTIONS	False	None
/api/util/snippet/<snippet_path>	api.snippet	GET, HEAD, OPTIONS	False	None
/api/util/tag/autocomplete	api.tag_autocomplete	GET, HEAD, OPTIONS	False	None
/api/util/user/autocomplete	api.user_autocomplete	GET, HEAD, OPTIONS	False	None
/catalog.<_format>	dcat.read_catalog	GET, HEAD, OPTIONS	False	None
/ckan-admin/	admin.index	GET, HEAD, OPTIONS	False	None
/ckan-admin/config	admin.config	GET, HEAD, OPTIONS, POST	False	None
/ckan-admin/reset_config	admin.reset_config	GET, HEAD, OPTIONS, POST	False	None
/ckan-admin/trash	admin.trash	GET, HEAD, OPTIONS, POST	False	None
/dashboard/	dashboard.index	GET, HEAD, OPTIONS	False	None
/dashboard/<int:offset>	dashboard.index	GET, HEAD, OPTIONS	False	None
/dashboard/datasets	dashboard.datasets	GET, HEAD, OPTIONS	False	None
/dashboard/groups	dashboard.groups	GET, HEAD, OPTIONS	False	None
/dashboard/organizations	dashboard.organizations	GET, HEAD, OPTIONS	False	None
/data_protection	statictheme.dataprotection	GET, HEAD, OPTIONS	False	None
/dataset	footer.display_mol_image	GET, HEAD, OPTIONS, POST	False	None
/dataset/	dataset.search	GET, HEAD, OPTIONS	False	None
/dataset/<_id>.<_format>	dcat.read_dataset	GET, HEAD, OPTIONS	False	None
/dataset/<id>	dataset.read	GET, HEAD, OPTIONS	False	None
/dataset/<id>/history	dataset.history	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>	dataset_resource.read	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>	resource.read	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/delete	dataset_resource.delete	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource/<resource_id>/delete	resource.delete	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource/<resource_id>/download	dataset_resource.download	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/download	resource.download	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/download/<filename>	dataset_resource.download	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/download/<filename>	resource.download	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/edit	dataset_resource.edit	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource/<resource_id>/edit	resource.edit	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource/<resource_id>/edit_view/<view_id>	dataset_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource/<resource_id>/edit_view/<view_id>	resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource/<resource_id>/embed	dataset_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/embed	resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/new_view	dataset_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource/<resource_id>/new_view	resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource/<resource_id>/preview	dataset_resource.datapreview	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/preview	resource.datapreview	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/proxy	resource_proxy.proxy_view	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/view	dataset_resource.view	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/view	resource.view	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/view/<view_id>	dataset_resource.view	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/view/<view_id>	resource.view	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/viewer	dataset_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/viewer	resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/views	dataset_resource.views	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/<resource_id>/views	resource.views	GET, HEAD, OPTIONS	False	None
/dataset/<id>/resource/new	dataset_resource.new	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource/new	resource.new	GET, HEAD, OPTIONS, POST	False	None
/dataset/<id>/resource_edit/<resource_id>	dataset.EditView	GET, HEAD, OPTIONS	False	None
/dataset/activity/<id>	dataset.activity	GET, HEAD, OPTIONS	False	None
/dataset/changes/<id>	dataset.changes	GET, HEAD, OPTIONS	False	None
/dataset/changes_multiple	dataset.changes_multiple	GET, HEAD, OPTIONS	False	None
/dataset/delete/<id>	dataset.delete	GET, HEAD, OPTIONS, POST	False	None
/dataset/edit/<id>	dataset.edit	GET, HEAD, OPTIONS, POST	False	None
/dataset/follow/<id>	dataset.follow	OPTIONS, POST	False	None
/dataset/followers/<id>	dataset.followers	GET, HEAD, OPTIONS	False	None
/dataset/groups/<id>	dataset.groups	GET, HEAD, OPTIONS, POST	False	None
/dataset/harvest_object/<id>	harvester.object_show	GET, HEAD, OPTIONS	False	None
/dataset/new	dataset.new	GET, HEAD, OPTIONS, POST	False	None
/dataset/new_resource/<id>	dataset.CreateView	GET, HEAD, OPTIONS	False	None
/dataset/resources/<id>	dataset.resources	GET, HEAD, OPTIONS	False	None
/dataset/unfollow/<id>	dataset.unfollow	OPTIONS, POST	False	None
/dataset4chem/	dataset4chem.search	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>	dataset4chem.read	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/history	dataset4chem.history	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/<resource_id>	dataset4chem_resource.read	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/<resource_id>/delete	dataset4chem_resource.delete	GET, HEAD, OPTIONS, POST	False	None
/dataset4chem/<id>/resource/<resource_id>/download	dataset4chem_resource.download	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/<resource_id>/download/<filename>	dataset4chem_resource.download	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/<resource_id>/edit	dataset4chem_resource.edit	GET, HEAD, OPTIONS, POST	False	None
/dataset4chem/<id>/resource/<resource_id>/edit_view/<view_id>	dataset4chem_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/dataset4chem/<id>/resource/<resource_id>/embed	dataset4chem_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/<resource_id>/new_view	dataset4chem_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/dataset4chem/<id>/resource/<resource_id>/preview	dataset4chem_resource.datapreview	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/<resource_id>/view	dataset4chem_resource.view	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/<resource_id>/view/<view_id>	dataset4chem_resource.view	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/<resource_id>/viewer	dataset4chem_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/<resource_id>/views	dataset4chem_resource.views	GET, HEAD, OPTIONS	False	None
/dataset4chem/<id>/resource/new	dataset4chem_resource.new	GET, HEAD, OPTIONS, POST	False	None
/dataset4chem/<id>/resource_edit/<resource_id>	dataset4chem.EditView	GET, HEAD, OPTIONS	False	None
/dataset4chem/activity/<id>	dataset4chem.activity	GET, HEAD, OPTIONS	False	None
/dataset4chem/changes/<id>	dataset4chem.changes	GET, HEAD, OPTIONS	False	None
/dataset4chem/changes_multiple	dataset4chem.changes_multiple	GET, HEAD, OPTIONS	False	None
/dataset4chem/delete/<id>	dataset4chem.delete	GET, HEAD, OPTIONS, POST	False	None
/dataset4chem/edit/<id>	dataset4chem.edit	GET, HEAD, OPTIONS, POST	False	None
/dataset4chem/follow/<id>	dataset4chem.follow	OPTIONS, POST	False	None
/dataset4chem/followers/<id>	dataset4chem.followers	GET, HEAD, OPTIONS	False	None
/dataset4chem/groups/<id>	dataset4chem.groups	GET, HEAD, OPTIONS, POST	False	None
/dataset4chem/new	dataset4chem.new	GET, HEAD, OPTIONS, POST	False	None
/dataset4chem/new_resource/<id>	dataset4chem.CreateView	GET, HEAD, OPTIONS	False	None
/dataset4chem/resources/<id>	dataset4chem.resources	GET, HEAD, OPTIONS	False	None
/dataset4chem/unfollow/<id>	dataset4chem.unfollow	OPTIONS, POST	False	None
/fancy_type/	fancy_type.search	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>	fancy_type.read	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/history	fancy_type.history	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/<resource_id>	fancy_type_resource.read	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/<resource_id>/delete	fancy_type_resource.delete	GET, HEAD, OPTIONS, POST	False	None
/fancy_type/<id>/resource/<resource_id>/download	fancy_type_resource.download	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/<resource_id>/download/<filename>	fancy_type_resource.download	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/<resource_id>/edit	fancy_type_resource.edit	GET, HEAD, OPTIONS, POST	False	None
/fancy_type/<id>/resource/<resource_id>/edit_view/<view_id>	fancy_type_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/fancy_type/<id>/resource/<resource_id>/embed	fancy_type_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/<resource_id>/new_view	fancy_type_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/fancy_type/<id>/resource/<resource_id>/preview	fancy_type_resource.datapreview	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/<resource_id>/view	fancy_type_resource.view	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/<resource_id>/view/<view_id>	fancy_type_resource.view	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/<resource_id>/viewer	fancy_type_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/<resource_id>/views	fancy_type_resource.views	GET, HEAD, OPTIONS	False	None
/fancy_type/<id>/resource/new	fancy_type_resource.new	GET, HEAD, OPTIONS, POST	False	None
/fancy_type/<id>/resource_edit/<resource_id>	fancy_type.EditView	GET, HEAD, OPTIONS	False	None
/fancy_type/activity/<id>	fancy_type.activity	GET, HEAD, OPTIONS	False	None
/fancy_type/changes/<id>	fancy_type.changes	GET, HEAD, OPTIONS	False	None
/fancy_type/changes_multiple	fancy_type.changes_multiple	GET, HEAD, OPTIONS	False	None
/fancy_type/delete/<id>	fancy_type.delete	GET, HEAD, OPTIONS, POST	False	None
/fancy_type/edit/<id>	fancy_type.edit	GET, HEAD, OPTIONS, POST	False	None
/fancy_type/follow/<id>	fancy_type.follow	OPTIONS, POST	False	None
/fancy_type/followers/<id>	fancy_type.followers	GET, HEAD, OPTIONS	False	None
/fancy_type/groups/<id>	fancy_type.groups	GET, HEAD, OPTIONS, POST	False	None
/fancy_type/new	fancy_type.new	GET, HEAD, OPTIONS, POST	False	None
/fancy_type/new_resource/<id>	fancy_type.CreateView	GET, HEAD, OPTIONS	False	None
/fancy_type/resources/<id>	fancy_type.resources	GET, HEAD, OPTIONS	False	None
/fancy_type/unfollow/<id>	fancy_type.unfollow	OPTIONS, POST	False	None
/feeds/custom.atom	feeds.custom	GET, HEAD, OPTIONS	False	None
/feeds/dataset.atom	feeds.general	GET, HEAD, OPTIONS	False	None
/feeds/group/<string:id>.atom	feeds.group	GET, HEAD, OPTIONS	False	None
/feeds/organization/<string:id>.atom	feeds.organization	GET, HEAD, OPTIONS	False	None
/feeds/tag/<string:id>.atom	feeds.tag	GET, HEAD, OPTIONS	False	None
/group/	group.index	GET, HEAD, OPTIONS	False	None
/group/<id>	group.read	GET, HEAD, OPTIONS	False	None
/group/about/<id>	group.about	GET, HEAD, OPTIONS	False	None
/group/activity/<id>	group.activity	GET, HEAD, OPTIONS, POST	False	None
/group/activity/<id>/<int:offset>	group.activity	GET, HEAD, OPTIONS	False	None
/group/admins/<id>	group.admins	GET, HEAD, OPTIONS, POST	False	None
/group/bulk_process/<id>	group.bulk_process	GET, HEAD, OPTIONS, POST	False	None
/group/delete/<id>	group.delete	GET, HEAD, OPTIONS, POST	False	None
/group/edit/<id>	group.edit	GET, HEAD, OPTIONS, POST	False	None
/group/follow/<id>	group.follow	GET, HEAD, OPTIONS, POST	False	None
/group/followers/<id>	group.followers	GET, HEAD, OPTIONS, POST	False	None
/group/history/<id>	group.history	GET, HEAD, OPTIONS, POST	False	None
/group/member_delete/<id>	group.member_delete	GET, HEAD, OPTIONS, POST	False	None
/group/member_new/<id>	group.member_new	GET, HEAD, OPTIONS, POST	False	None
/group/members/<id>	group.members	GET, HEAD, OPTIONS, POST	False	None
/group/new	group.new	GET, HEAD, OPTIONS, POST	False	None
/group/unfollow/<id>	group.unfollow	GET, HEAD, OPTIONS, POST	False	None
/harvest/	harvest.search	GET, HEAD, OPTIONS	False	None
/harvest/<id>	harvest.read	GET, HEAD, OPTIONS	False	None
/harvest/<id>/history	harvest.history	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/<resource_id>	harvest_resource.read	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/<resource_id>/delete	harvest_resource.delete	GET, HEAD, OPTIONS, POST	False	None
/harvest/<id>/resource/<resource_id>/download	harvest_resource.download	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/<resource_id>/download/<filename>	harvest_resource.download	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/<resource_id>/edit	harvest_resource.edit	GET, HEAD, OPTIONS, POST	False	None
/harvest/<id>/resource/<resource_id>/edit_view/<view_id>	harvest_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/harvest/<id>/resource/<resource_id>/embed	harvest_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/<resource_id>/new_view	harvest_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/harvest/<id>/resource/<resource_id>/preview	harvest_resource.datapreview	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/<resource_id>/view	harvest_resource.view	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/<resource_id>/view/<view_id>	harvest_resource.view	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/<resource_id>/viewer	harvest_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/<resource_id>/views	harvest_resource.views	GET, HEAD, OPTIONS	False	None
/harvest/<id>/resource/new	harvest_resource.new	GET, HEAD, OPTIONS, POST	False	None
/harvest/<id>/resource_edit/<resource_id>	harvest.EditView	GET, HEAD, OPTIONS	False	None
/harvest/<source>/job	harvester.job_list	GET, HEAD, OPTIONS	False	None
/harvest/<source>/job/<id>	harvester.job_show	GET, HEAD, OPTIONS	False	None
/harvest/<source>/job/<id>/abort	harvester.job_abort	GET, HEAD, OPTIONS	False	None
/harvest/<source>/job/last	harvester.job_show_last	GET, HEAD, OPTIONS	False	None
/harvest/about/<id>	harvester.about	GET, HEAD, OPTIONS	False	None
/harvest/activity/<id>	harvest.activity	GET, HEAD, OPTIONS	False	None
/harvest/admin/<id>	harvester.admin	GET, HEAD, OPTIONS	False	None
/harvest/changes/<id>	harvest.changes	GET, HEAD, OPTIONS	False	None
/harvest/changes_multiple	harvest.changes_multiple	GET, HEAD, OPTIONS	False	None
/harvest/clear/<id>	harvester.clear	GET, HEAD, OPTIONS, POST	False	None
/harvest/delete/<id>	harvester.delete	GET, HEAD, OPTIONS	False	None
/harvest/delete/<id>	harvest.delete	GET, HEAD, OPTIONS, POST	False	None
/harvest/edit/<id>	harvest.edit	GET, HEAD, OPTIONS, POST	False	None
/harvest/follow/<id>	harvest.follow	OPTIONS, POST	False	None
/harvest/followers/<id>	harvest.followers	GET, HEAD, OPTIONS	False	None
/harvest/groups/<id>	harvest.groups	GET, HEAD, OPTIONS, POST	False	None
/harvest/new	harvest.new	GET, HEAD, OPTIONS, POST	False	None
/harvest/new_resource/<id>	harvest.CreateView	GET, HEAD, OPTIONS	False	None
/harvest/object/<id>	harvester.object_show	GET, HEAD, OPTIONS	False	None
/harvest/refresh/<id>	harvester.refresh	GET, HEAD, OPTIONS, POST	False	None
/harvest/resources/<id>	harvest.resources	GET, HEAD, OPTIONS	False	None
/harvest/unfollow/<id>	harvest.unfollow	OPTIONS, POST	False	None
/help	statictheme.help	GET, HEAD, OPTIONS	False	None
/imprint	statictheme.imprint	GET, HEAD, OPTIONS	False	None
/localhost:5000/dataset/<package_name>	rdkit_visuals.display_image	OPTIONS, POST	False	None
/localhost:5000/fancy_type/<package_name>	related_resources.save_relationships	OPTIONS, POST	False	None
/molecule/	molecule.search	GET, HEAD, OPTIONS	False	None
/molecule/<id>	molecule.read	GET, HEAD, OPTIONS	False	None
/molecule/<id>/history	molecule.history	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/<resource_id>	molecule_resource.read	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/<resource_id>/delete	molecule_resource.delete	GET, HEAD, OPTIONS, POST	False	None
/molecule/<id>/resource/<resource_id>/download	molecule_resource.download	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/<resource_id>/download/<filename>	molecule_resource.download	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/<resource_id>/edit	molecule_resource.edit	GET, HEAD, OPTIONS, POST	False	None
/molecule/<id>/resource/<resource_id>/edit_view/<view_id>	molecule_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/molecule/<id>/resource/<resource_id>/embed	molecule_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/<resource_id>/new_view	molecule_resource.edit_view	GET, HEAD, OPTIONS, POST	False	None
/molecule/<id>/resource/<resource_id>/preview	molecule_resource.datapreview	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/<resource_id>/view	molecule_resource.view	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/<resource_id>/view/<view_id>	molecule_resource.view	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/<resource_id>/viewer	molecule_resource.embedded_dataviewer	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/<resource_id>/views	molecule_resource.views	GET, HEAD, OPTIONS	False	None
/molecule/<id>/resource/new	molecule_resource.new	GET, HEAD, OPTIONS, POST	False	None
/molecule/<id>/resource_edit/<resource_id>	molecule.EditView	GET, HEAD, OPTIONS	False	None
/molecule/activity/<id>	molecule.activity	GET, HEAD, OPTIONS	False	None
/molecule/changes/<id>	molecule.changes	GET, HEAD, OPTIONS	False	None
/molecule/changes_multiple	molecule.changes_multiple	GET, HEAD, OPTIONS	False	None
/molecule/delete/<id>	molecule.delete	GET, HEAD, OPTIONS, POST	False	None
/molecule/edit/<id>	molecule.edit	GET, HEAD, OPTIONS, POST	False	None
/molecule/follow/<id>	molecule.follow	OPTIONS, POST	False	None
/molecule/followers/<id>	molecule.followers	GET, HEAD, OPTIONS	False	None
/molecule/groups/<id>	molecule.groups	GET, HEAD, OPTIONS, POST	False	None
/molecule/new	molecule.new	GET, HEAD, OPTIONS, POST	False	None
/molecule/new_resource/<id>	molecule.CreateView	GET, HEAD, OPTIONS	False	None
/molecule/resources/<id>	molecule.resources	GET, HEAD, OPTIONS	False	None
/molecule/unfollow/<id>	molecule.unfollow	OPTIONS, POST	False	None
/molecule_view	footer.molecule_view	GET, HEAD, OPTIONS, POST	False	None
/moleculesearch	footer.molecule_view_self	GET, HEAD, OPTIONS, POST	False	None
/organization/	organization.index	GET, HEAD, OPTIONS	False	None
/organization/<id>	organization.read	GET, HEAD, OPTIONS	False	None
/organization/about/<id>	organization.about	GET, HEAD, OPTIONS	False	None
/organization/activity/<id>	organization.activity	GET, HEAD, OPTIONS, POST	False	None
/organization/activity/<id>/<int:offset>	organization.activity	GET, HEAD, OPTIONS	False	None
/organization/admins/<id>	organization.admins	GET, HEAD, OPTIONS, POST	False	None
/organization/bulk_process/<id>	organization.bulk_process	GET, HEAD, OPTIONS, POST	False	None
/organization/delete/<id>	organization.delete	GET, HEAD, OPTIONS, POST	False	None
/organization/edit/<id>	organization.edit	GET, HEAD, OPTIONS, POST	False	None
/organization/follow/<id>	organization.follow	GET, HEAD, OPTIONS, POST	False	None
/organization/followers/<id>	organization.followers	GET, HEAD, OPTIONS, POST	False	None
/organization/history/<id>	organization.history	GET, HEAD, OPTIONS, POST	False	None
/organization/member_delete/<id>	organization.member_delete	GET, HEAD, OPTIONS, POST	False	None
/organization/member_new/<id>	organization.member_new	GET, HEAD, OPTIONS, POST	False	None
/organization/members/<id>	organization.members	GET, HEAD, OPTIONS, POST	False	None
/organization/new	organization.new	GET, HEAD, OPTIONS, POST	False	None
/organization/unfollow/<id>	organization.unfollow	GET, HEAD, OPTIONS, POST	False	None
/repository/	repository.index	GET, HEAD, OPTIONS	False	None
/repository/<id>	repository.read	GET, HEAD, OPTIONS	False	None
/repository/about/<id>	repository.about	GET, HEAD, OPTIONS	False	None
/repository/activity/<id>	repository.activity	GET, HEAD, OPTIONS, POST	False	None
/repository/activity/<id>/<int:offset>	repository.activity	GET, HEAD, OPTIONS	False	None
/repository/admins/<id>	repository.admins	GET, HEAD, OPTIONS, POST	False	None
/repository/bulk_process/<id>	repository.bulk_process	GET, HEAD, OPTIONS, POST	False	None
/repository/delete/<id>	repository.delete	GET, HEAD, OPTIONS, POST	False	None
/repository/edit/<id>	repository.edit	GET, HEAD, OPTIONS, POST	False	None
/repository/follow/<id>	repository.follow	GET, HEAD, OPTIONS, POST	False	None
/repository/followers/<id>	repository.followers	GET, HEAD, OPTIONS, POST	False	None
/repository/history/<id>	repository.history	GET, HEAD, OPTIONS, POST	False	None
/repository/member_delete/<id>	repository.member_delete	GET, HEAD, OPTIONS, POST	False	None
/repository/member_new/<id>	repository.member_new	GET, HEAD, OPTIONS, POST	False	None
/repository/members/<id>	repository.members	GET, HEAD, OPTIONS, POST	False	None
/repository/new	repository.new	GET, HEAD, OPTIONS, POST	False	None
/repository/unfollow/<id>	repository.unfollow	GET, HEAD, OPTIONS, POST	False	None
/search_bar	footer.search_bar	GET, HEAD, OPTIONS, POST	False	None
/testing/primer	util.primer	GET, HEAD, OPTIONS	False	None
/user/	user.index	GET, HEAD, OPTIONS	False	None
/user/<id>	user.read	GET, HEAD, OPTIONS	False	None
/user/<id>/api-tokens	user.api_tokens	GET, HEAD, OPTIONS, POST	False	None
/user/<id>/api-tokens/<jti>/revoke	user.api_token_revoke	OPTIONS, POST	False	None
/user/_logout	user.logout	GET, HEAD, OPTIONS	False	None
/user/activity/<id>	user.activity	GET, HEAD, OPTIONS	False	None
/user/activity/<id>/<int:offset>	user.activity	GET, HEAD, OPTIONS	False	None
/user/delete/<id>	user.delete	OPTIONS, POST	False	None
/user/edit	user.edit	GET, HEAD, OPTIONS, POST	False	None
/user/edit/<id>	user.edit	GET, HEAD, OPTIONS, POST	False	None
/user/follow/<id>	user.follow	OPTIONS, POST	False	None
/user/followers/<id>	user.followers	GET, HEAD, OPTIONS	False	None
/user/generate_key	user.generate_apikey	OPTIONS, POST	False	None
/user/generate_key/<id>	user.generate_apikey	OPTIONS, POST	False	None
/user/logged_in	user.logged_in	GET, HEAD, OPTIONS	False	None
/user/logged_out	user.logged_out	GET, HEAD, OPTIONS	False	None
/user/logged_out_redirect	user.logged_out_page	GET, HEAD, OPTIONS	False	None
/user/login	user.login	GET, HEAD, OPTIONS	False	None
/user/me	user.me	GET, HEAD, OPTIONS	False	None
/user/register	user.register	GET, HEAD, OPTIONS, POST	False	None
/user/reset	user.request_reset	GET, HEAD, OPTIONS, POST	False	None
/user/reset/<id>	user.perform_reset	GET, HEAD, OPTIONS, POST	False	None
/user/unfollow/<id>	user.unfollow	OPTIONS, POST	False	None
/util/redirect	util.internal_redirect	GET, HEAD, OPTIONS, POST	False	None
/webassets/<path:path>	webassets.index	GET, HEAD, OPTIONS	False	None
/zh_CN/	home.redirect_locale	GET, HEAD, OPTIONS	False	None
/zh_CN/<path:path>	home.redirect_locale	GET, HEAD, OPTIONS	False	None
/zh_TW/	home.redirect_locale	GET, HEAD, OPTIONS	False	None
/zh_TW/<path:path>	home.redirect_locale	GET, HEAD, OPTIONS	False	None

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Supplementary material for 'Influence of Layer Slipping on Adsorption of Ligh... Dataset

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