{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,4,30]],"date-time":"2026-04-30T18:05:59Z","timestamp":1777572359458,"version":"3.51.4"},"reference-count":43,"publisher":"American Chemical Society (ACS)","issue":"1","license":[{"start":{"date-parts":[[2020,12,18]],"date-time":"2020-12-18T00:00:00Z","timestamp":1608249600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2020,12,18]],"date-time":"2020-12-18T00:00:00Z","timestamp":1608249600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2020,12,18]],"date-time":"2020-12-18T00:00:00Z","timestamp":1608249600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2021,1,25]]},"DOI":"10.1021\/acs.jcim.0c00936","type":"journal-article","created":{"date-parts":[[2020,12,18]],"date-time":"2020-12-18T13:27:33Z","timestamp":1608298053000},"page":"179-188","source":"Crossref","is-referenced-by-count":27,"title":["Chemography: Searching for Hidden Treasures"],"prefix":"10.1021","volume":"61","author":[{"given":"Yuliana","family":"Zabolotna","sequence":"first","affiliation":[{"name":"University of Strasbourg, Laboratoire de Chemoinformatique, 4, rue B. Pascal, Strasbourg 67081 France"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Arkadii","family":"Lin","sequence":"additional","affiliation":[{"name":"University of Strasbourg, Laboratoire de Chemoinformatique, 4, rue B. Pascal, Strasbourg 67081 France"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-0173-5714","authenticated-orcid":true,"given":"Dragos","family":"Horvath","sequence":"additional","affiliation":[{"name":"University of Strasbourg, Laboratoire de Chemoinformatique, 4, rue B. Pascal, Strasbourg 67081 France"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-1676-6708","authenticated-orcid":true,"given":"Gilles","family":"Marcou","sequence":"additional","affiliation":[{"name":"University of Strasbourg, Laboratoire de Chemoinformatique, 4, rue B. Pascal, Strasbourg 67081 France"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Dmitriy M.","family":"Volochnyuk","sequence":"additional","affiliation":[{"name":"Institute of Organic Chemistry National Academy of Sciences of Ukraine, Murmanska Street 5, Kyiv 02660, Ukraine"},{"name":"Enamine Ltd., Chervonotkatska Street 78, Kyiv 02094, Ukraine"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-1886-925X","authenticated-orcid":true,"given":"Alexandre","family":"Varnek","sequence":"additional","affiliation":[{"name":"University of Strasbourg, Laboratoire de Chemoinformatique, 4, rue B. Pascal, Strasbourg 67081 France"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2020,12,18]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.5b00559"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1007\/s10822-013-9672-4"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkr777"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.8b01048"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1021\/ci034260m"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1021\/ci900464s"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.5b00116"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1039\/c2md00302c"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1016\/j.compbiolchem.2004.11.003"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1007\/s11030-006-9040-6"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1016\/j.drudis.2018.10.016"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1186\/s13321-017-0212-4"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1021\/jm9602928"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.5b01746"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1002\/qsar.200610091"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1038\/nchembio0807-442"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1002\/cpph.67"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1016\/S1359-6446(03)02831-9"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1021\/jm701122q"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1016\/S1056-8719(00)00107-6"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1016\/j.cbpa.2011.05.024"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1162\/089976698300017953"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1002\/cmdc.201700561"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gky1033"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.8b00650"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1021\/cc0000388"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1007\/BF00337288"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btn186"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1007\/s10822-019-00215-x"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1109\/34.1000238"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1002\/minf.201400153"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1002\/minf.201100163"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1007\/s10822-019-00188-x"},{"key":"ref34\/cit34","doi-asserted-by":"crossref","first-page":"43","DOI":"10.1002\/3527603743.ch3","volume-title":"Chemoinformatics in Drug Discovery","author":"Hann M. M.","year":"2005"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-019-13807-w"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1021\/cn3000422"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1002\/minf.201000099"},{"key":"ref38\/cit38","first-page":"1","volume-title":"The Practice of Medicinal Chemistry","author":"Chast F.","year":"2008","edition":"3"},{"key":"ref39\/cit39","first-page":"560","author":"Jha K. K.","year":"2012","journal-title":"J. Pharm. Res."},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1002\/chem.201903232"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1126\/scitranslmed.aav5464"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1002\/minf.201800166"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1016\/j.ejmech.2019.01.010"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.0c00936","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,26]],"date-time":"2023-04-26T00:17:12Z","timestamp":1682468232000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.0c00936"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2020,12,18]]},"references-count":43,"journal-issue":{"issue":"1","published-print":{"date-parts":[[2021,1,25]]}},"alternative-id":["10.1021\/acs.jcim.0c00936"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.0c00936","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2020,12,18]]}}}