{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,3,12]],"date-time":"2026-03-12T12:07:38Z","timestamp":1773317258587,"version":"3.50.1"},"reference-count":46,"publisher":"American Chemical Society (ACS)","issue":"7","license":[{"start":{"date-parts":[[2024,1,30]],"date-time":"2024-01-30T00:00:00Z","timestamp":1706572800000},"content-version":"unspecified","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"funder":[{"DOI":"10.13039\/100009045","name":"Uniwersytet Jagiellonski Collegium Medicum","doi-asserted-by":"publisher","award":["7N42\/DBS\/000205"],"award-info":[{"award-number":["7N42\/DBS\/000205"]}],"id":[{"id":"10.13039\/100009045","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2024,4,8]]},"DOI":"10.1021\/acs.jcim.3c01517","type":"journal-article","created":{"date-parts":[[2024,1,30]],"date-time":"2024-01-30T13:53:11Z","timestamp":1706622791000},"page":"2150-2157","source":"Crossref","is-referenced-by-count":11,"title":["SerotoninAI: Serotonergic System Focused, Artificial Intelligence-Based Application for Drug Discovery"],"prefix":"10.1021","volume":"64","author":[{"ORCID":"https:\/\/orcid.org\/0000-0001-6660-4446","authenticated-orcid":true,"given":"Natalia","family":"\u0141api\u0144ska","sequence":"first","affiliation":[{"name":"Department of Pharmaceutical Technology and Biopharmaceutics, Jagiellonian University Medical College, 30-688 Krak\u00f3w, Poland"},{"name":"Doctoral School of Medicinal and Health Sciences, Jagiellonian University Medical College, 30-688 Krak\u00f3w, Poland"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-2801-6197","authenticated-orcid":true,"given":"Adam","family":"Pac\u0142awski","sequence":"additional","affiliation":[{"name":"Department of Pharmaceutical Technology and Biopharmaceutics, Jagiellonian University Medical College, 30-688 Krak\u00f3w, Poland"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-1537-9650","authenticated-orcid":true,"given":"Jakub","family":"Szl\u0119k","sequence":"additional","affiliation":[{"name":"Department of Pharmaceutical Technology and Biopharmaceutics, Jagiellonian University Medical College, 30-688 Krak\u00f3w, Poland"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-4394-9115","authenticated-orcid":true,"given":"Aleksander","family":"Mendyk","sequence":"additional","affiliation":[{"name":"Department of Pharmaceutical Technology and Biopharmaceutics, Jagiellonian University Medical College, 30-688 Krak\u00f3w, Poland"}]}],"member":"316","published-online":{"date-parts":[[2024,1,30]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1016\/j.drudis.2020.10.010"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1007\/s11030-021-10217-3"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1186\/s12859-019-3135-4"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2018.01275"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1021\/ci010289j"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1007\/978-1-4939-9089-4_8"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1016\/j.neuropharm.2020.108155"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1085\/jgp.201812066"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1016\/j.pharmthera.2021.107937"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1021\/acs.molpharmaceut.2c01117"},{"key":"ref11\/cit11","unstructured":"NovaDock. https:\/\/www.dnastar.com\/software\/nova-protein-modeling\/novadock\/ (accessed October 23, 2023)."},{"key":"ref12\/cit12","unstructured":"AutoDock. https:\/\/autodock.scripps.edu\/ (accessed October 24, 2023)."},{"key":"ref13\/cit13","unstructured":"VEGA\nQSAR. https:\/\/www.vegahub.eu\/about-vegahub\/ (accessed October 23, 2023)."},{"key":"ref14\/cit14","unstructured":"QSAR\nTOOLBOX. https:\/\/qsartoolbox.org\/ (accessed October 23, 2023)."},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.9b00295"},{"key":"ref16\/cit16","unstructured":"PharmQSAR. https:\/\/pharmacelera.com\/pharmqsar\/, (accessed October 25, 2023)."},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1080\/14756366.2016.1247057"},{"key":"ref18\/cit18","unstructured":"AiQSAR. https:\/\/www.vegahub.eu\/portfolio-item\/aiqsar\/ (accessed October 24, 2023)."},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1186\/s13321-017-0256-5"},{"key":"ref20\/cit20","unstructured":"The GNU\nGeneral Public License, Version 3, 29 June 2007. https:\/\/www.gnu.org\/licenses\/gpl-3.0.html (accessed July 5, 2023)."},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1021\/ci049714+"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gky1075"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0220113"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1038\/s41598-019-44773-4"},{"key":"ref25\/cit25","unstructured":"Online chemical\ndatabase with modeling environment. https:\/\/ochem.eu\/home\/show.do (accessed July 16, 2023)."},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1186\/s13321-018-0258-y"},{"key":"ref27\/cit27","unstructured":"Plonska, A.; Plonski, P. MLJAR: State-of-the-Art Automated Machine Learning Framework for Tabular Data, version 0.10.3. https:\/\/github.com\/mljar\/mljar-supervised."},{"key":"ref28\/cit28","unstructured":"Guidance\nDocument on the Validation of (Quantitative) Structure-Activity Relationship\n[(Q)SAR] Models. https:\/\/www.oecd.org\/env\/guidance-document-on-the-validation-of-quantitative-structure-activity-relationship-q-sar-models-9789264085442-en.htm (accessed July 15, 2023)."},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1007\/BF02246453"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1038\/sj.npp.1300203"},{"key":"ref31\/cit31","unstructured":"Santa\nCruz. https:\/\/www.scbt.com\/p\/zolmitriptan-139264-17-8 (accessed November\n22, 2023)."},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1016\/S0014-2999(01)01493-5"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-022-05258-z"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.3390\/molecules27196492"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.1c02031"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.3390\/molecules28031108"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1016\/j.ejmech.2023.115695"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1016\/j.arabjc.2023.104636"},{"key":"ref39\/cit39","unstructured":"Shapley, L. S. A Value for N-Person Games. RAND Corporation: Santa Monica, CA, 1952. https:\/\/www.rand.org\/pubs\/papers\/P295.html."},{"key":"ref40\/cit40","unstructured":"Lundberg, S.; Lee, S. I. A Unified Approach to Interpreting Model Predictions.  ArXiv Preprint, arXiv:1705.07874, 2017."},{"key":"ref41\/cit41","unstructured":"Szl\u0119k, J. Model Interpretation. https:\/\/github.com\/jszlek\/MODEL_INTERPRETATION (accessed July 15, 2023)."},{"key":"ref42\/cit42","unstructured":"Steamlit:\na faster way to build and share data apps. https:\/\/streamlit.io\/ (accessed\nJune 2, 2023)."},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1177\/0271678X18788769"},{"key":"ref44\/cit44","unstructured":"Canva. https:\/\/www.canva.com\/ (accessed\n10 June 2023)."},{"key":"ref45\/cit45a","unstructured":"Streamlit\nketcher. https:\/\/github.com\/mik-laj\/streamlit-ketcher?ref=blog.streamlit.io (accessed July 15, 2023)."},{"key":"ref45\/cit45b","doi-asserted-by":"publisher","DOI":"10.1016\/j.ejpb.2016.11.034"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.3c01517","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.3c01517","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2024,4,8]],"date-time":"2024-04-08T09:43:49Z","timestamp":1712569429000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.3c01517"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2024,1,30]]},"references-count":46,"journal-issue":{"issue":"7","published-print":{"date-parts":[[2024,4,8]]}},"alternative-id":["10.1021\/acs.jcim.3c01517"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.3c01517","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2024,1,30]]}}}