{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,3]],"date-time":"2026-07-03T02:04:00Z","timestamp":1783044240036,"version":"3.54.6"},"reference-count":166,"publisher":"American Chemical Society (ACS)","issue":"1","license":[{"start":{"date-parts":[[2023,12,27]],"date-time":"2023-12-27T00:00:00Z","timestamp":1703635200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2023,12,27]],"date-time":"2023-12-27T00:00:00Z","timestamp":1703635200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2023,12,27]],"date-time":"2023-12-27T00:00:00Z","timestamp":1703635200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/501100003395","name":"Shanghai Municipal Education Commission","doi-asserted-by":"publisher","id":[{"id":"10.13039\/501100003395","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["82173746"],"award-info":[{"award-number":["82173746"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["U23A20530"],"award-info":[{"award-number":["U23A20530"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["82104066"],"award-info":[{"award-number":["82104066"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2024,1,8]]},"DOI":"10.1021\/acs.jcim.3c01613","type":"journal-article","created":{"date-parts":[[2023,12,27]],"date-time":"2023-12-27T19:13:10Z","timestamp":1703704390000},"page":"57-75","source":"Crossref","is-referenced-by-count":30,"title":["Network-Based Methods and Their Applications in Drug Discovery"],"prefix":"10.1021","volume":"64","author":[{"given":"Zhuohang","family":"Yu","sequence":"first","affiliation":[{"name":"Shanghai Frontiers Science Center of Optogenetic Techniques for Cell Metabolism, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3095-6006","authenticated-orcid":true,"given":"Zengrui","family":"Wu","sequence":"additional","affiliation":[{"name":"Shanghai Frontiers Science Center of Optogenetic Techniques for Cell Metabolism, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Ze","family":"Wang","sequence":"additional","affiliation":[{"name":"Shanghai Frontiers Science Center of Optogenetic Techniques for Cell Metabolism, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yimeng","family":"Wang","sequence":"additional","affiliation":[{"name":"Shanghai Frontiers Science Center of Optogenetic Techniques for Cell Metabolism, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Moran","family":"Zhou","sequence":"additional","affiliation":[{"name":"Shanghai Frontiers Science Center of Optogenetic Techniques for Cell Metabolism, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-7055-9836","authenticated-orcid":true,"given":"Weihua","family":"Li","sequence":"additional","affiliation":[{"name":"Shanghai Frontiers Science Center of Optogenetic Techniques for Cell Metabolism, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-9648-844X","authenticated-orcid":true,"given":"Guixia","family":"Liu","sequence":"additional","affiliation":[{"name":"Shanghai Frontiers Science Center of Optogenetic Techniques for Cell Metabolism, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-2340-1109","authenticated-orcid":true,"given":"Yun","family":"Tang","sequence":"additional","affiliation":[{"name":"Shanghai Frontiers Science Center of Optogenetic Techniques for Cell Metabolism, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2023,12,27]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1016\/j.jhealeco.2016.01.012"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1038\/nrd.2018.168"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1038\/nchembio.118"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1016\/j.drudis.2013.01.008"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1038\/nrd1346"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1021\/jm5006463"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2018.01134"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1016\/j.drudis.2017.12.001"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbx017"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1021\/acs.chemrev.8b00728"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbs043"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbv066"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.9b00387"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1039\/c2mb25110h"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1039\/D1DD00011J"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.1c01830"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1021\/acs.accounts.6b00491"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkx374"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1021\/jm801649y"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1021\/ci300030u"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.8b00698"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1039\/D1SC05613A"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbw012"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1111\/bph.13629"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pcbi.1002503"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.1c00260"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1016\/j.phrs.2017.11.005"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1038\/s41573-022-00472-w"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-023-37570-1"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1016\/j.chembiol.2018.01.015"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-018-05116-5"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1038\/ncomms10331"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1016\/j.csbj.2022.12.022"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkx1037"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkaa971"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkac1085"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1186\/1758-2946-3-33"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21707"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkac1052"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkw1000"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-021-03819-2"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gky1151"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkaa1043"},{"key":"ref44\/cit44","doi-asserted-by":"publisher","DOI":"10.2165\/00002018-200427080-00010"},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkh061"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1002\/cpbi.5"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkac888"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/29.1.308"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkaa970"},{"key":"ref50\/cit50","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkz1031"},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkaa1024"},{"key":"ref52\/cit52","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkn653"},{"key":"ref53\/cit53","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gky1075"},{"key":"ref54\/cit54","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkv1072"},{"key":"ref55\/cit55","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkab1010"},{"key":"ref56\/cit56","doi-asserted-by":"publisher","DOI":"10.1177\/107385840000600408"},{"key":"ref57\/cit57","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btu626"},{"key":"ref58\/cit58","doi-asserted-by":"publisher","DOI":"10.1038\/sdata.2017.29"},{"key":"ref59\/cit59","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btaa973"},{"key":"ref60\/cit60","doi-asserted-by":"publisher","DOI":"10.1021\/ci4000079"},{"key":"ref61\/cit61","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkv1075"},{"key":"ref62\/cit62","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkaa891"},{"key":"ref63\/cit63","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gku1066"},{"key":"ref64\/cit64","doi-asserted-by":"publisher","DOI":"10.1126\/scitranslmed.3003377"},{"key":"ref65\/cit65","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkac1010"},{"key":"ref66\/cit66","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkz1021"},{"key":"ref67\/cit67","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkx1153"},{"key":"ref68\/cit68","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkv1317"},{"key":"ref69\/cit69","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkab880"},{"key":"ref70\/cit70","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkz1007"},{"key":"ref71\/cit71","doi-asserted-by":"publisher","DOI":"10.1093\/database\/bau124"},{"key":"ref72\/cit72","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkz337"},{"key":"ref73\/cit73","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkac1000"},{"key":"ref74\/cit74","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gky1079"},{"key":"ref75\/cit75","doi-asserted-by":"publisher","DOI":"10.1002\/wsbm.1417"},{"key":"ref76\/cit76","doi-asserted-by":"publisher","DOI":"10.1021\/ci300367a"},{"key":"ref77\/cit77","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/bty707"},{"key":"ref78\/cit78","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkab255"},{"key":"ref79\/cit79","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevE.76.046115"},{"key":"ref80\/cit80","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.1000488107"},{"key":"ref81\/cit81","unstructured":"Lov\u00e1sz, L. Random Walks on Graphs: A Survey; 1993; pp 1\u201346."},{"key":"ref82\/cit82","doi-asserted-by":"publisher","DOI":"10.1186\/s12859-016-1336-7"},{"key":"ref83\/cit83","doi-asserted-by":"publisher","DOI":"10.1186\/1471-2164-13-S7-S27"},{"key":"ref84\/cit84","doi-asserted-by":"publisher","DOI":"10.1016\/j.ajhg.2008.02.013"},{"key":"ref85\/cit85","doi-asserted-by":"publisher","DOI":"10.1039\/c2mb00002d"},{"key":"ref86\/cit86","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/bty637"},{"key":"ref87\/cit87","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btw228"},{"key":"ref88\/cit88","doi-asserted-by":"publisher","DOI":"10.1126\/science.1257601"},{"key":"ref89\/cit89","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pcbi.1004120"},{"key":"ref90\/cit90","doi-asserted-by":"publisher","DOI":"10.1016\/j.cels.2019.04.005"},{"key":"ref91\/cit91","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-019-09186-x"},{"key":"ref92\/cit92","doi-asserted-by":"publisher","DOI":"10.1038\/srep01613"},{"key":"ref93\/cit93","doi-asserted-by":"publisher","DOI":"10.1088\/1367-2630\/17\/11\/113037"},{"key":"ref94\/cit94","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbx041"},{"key":"ref95\/cit95","doi-asserted-by":"publisher","DOI":"10.1186\/s13321-016-0128-4"},{"key":"ref96\/cit96","doi-asserted-by":"publisher","DOI":"10.1016\/j.bbadis.2017.12.019"},{"key":"ref97\/cit97","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btt307"},{"key":"ref98\/cit98","doi-asserted-by":"publisher","DOI":"10.1038\/s41598-021-87234-7"},{"key":"ref99\/cit99","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btaa563"},{"key":"ref100\/cit100","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2021.754175"},{"key":"ref101\/cit101","doi-asserted-by":"publisher","DOI":"10.3233\/JAD-220727"},{"key":"ref102\/cit102","doi-asserted-by":"publisher","DOI":"10.1016\/S1359-6446(02)02483-2"},{"key":"ref103\/cit103","doi-asserted-by":"publisher","DOI":"10.1016\/j.drudis.2006.05.012"},{"key":"ref104\/cit104","doi-asserted-by":"publisher","DOI":"10.1038\/nrd1468"},{"key":"ref105\/cit105","doi-asserted-by":"publisher","DOI":"10.1016\/j.artmed.2014.11.003"},{"key":"ref106\/cit106","doi-asserted-by":"publisher","DOI":"10.1186\/s12859-019-3117-6"},{"key":"ref107\/cit107","doi-asserted-by":"publisher","DOI":"10.1016\/j.compbiomed.2023.106969"},{"key":"ref108\/cit108","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0162407"},{"key":"ref109\/cit109","doi-asserted-by":"publisher","DOI":"10.1002\/minf.202200001"},{"key":"ref110\/cit110","doi-asserted-by":"publisher","DOI":"10.1002\/cmdc.202100620"},{"key":"ref111\/cit111","doi-asserted-by":"publisher","DOI":"10.1038\/s43587-021-00138-z"},{"key":"ref112\/cit112","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbaa027"},{"key":"ref113\/cit113","doi-asserted-by":"publisher","DOI":"10.1016\/j.jbi.2015.09.016"},{"key":"ref114\/cit114","doi-asserted-by":"publisher","DOI":"10.1001\/jama.2015.1815"},{"key":"ref115\/cit115","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.7b00216"},{"key":"ref116\/cit116","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2017.00747"},{"key":"ref117\/cit117","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.3c00018"},{"key":"ref118\/cit118","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbab580"},{"key":"ref119\/cit119","doi-asserted-by":"publisher","DOI":"10.1186\/s12911-019-0999-1"},{"key":"ref167\/cit167","doi-asserted-by":"publisher","DOI":"10.1016\/j.compbiomed.2023.107831"},{"key":"ref120\/cit120","doi-asserted-by":"publisher","DOI":"10.1007\/s40264-022-01225-9"},{"key":"ref121\/cit121","doi-asserted-by":"publisher","DOI":"10.3390\/ijms20020386"},{"key":"ref122\/cit122","doi-asserted-by":"publisher","DOI":"10.1126\/science.1158140"},{"key":"ref123\/cit123","doi-asserted-by":"publisher","DOI":"10.1038\/nature11159"},{"key":"ref124\/cit124","doi-asserted-by":"publisher","DOI":"10.1016\/j.toxlet.2019.05.005"},{"key":"ref125\/cit125","doi-asserted-by":"publisher","DOI":"10.1021\/acs.est.2c08558"},{"key":"ref126\/cit126","doi-asserted-by":"publisher","DOI":"10.1021\/acs.cgd.0c00911"},{"key":"ref127\/cit127","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.1c00601"},{"key":"ref128\/cit128","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.3c00066"},{"key":"ref129\/cit129","doi-asserted-by":"publisher","DOI":"10.1038\/nrd.2017.226"},{"key":"ref130\/cit130","doi-asserted-by":"publisher","DOI":"10.1016\/j.canlet.2019.05.015"},{"key":"ref131\/cit131","doi-asserted-by":"publisher","DOI":"10.1158\/2159-8290.CD-22-0342"},{"key":"ref132\/cit132","doi-asserted-by":"publisher","DOI":"10.1016\/S1875-5364(21)60001-8"},{"key":"ref133\/cit133","doi-asserted-by":"publisher","DOI":"10.3724\/SP.J.1009.2013.00110"},{"key":"ref134\/cit134","doi-asserted-by":"publisher","DOI":"10.1021\/acs.chemrestox.0c00359"},{"key":"ref135\/cit135","doi-asserted-by":"publisher","DOI":"10.1007\/s40203-022-00124-2"},{"key":"ref136\/cit136","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2021.587850"},{"key":"ref137\/cit137","doi-asserted-by":"publisher","DOI":"10.3389\/fonc.2022.865409"},{"key":"ref138\/cit138","doi-asserted-by":"publisher","DOI":"10.1016\/j.jep.2023.116912"},{"key":"ref139\/cit139","doi-asserted-by":"publisher","DOI":"10.1186\/s12906-020-03106-z"},{"key":"ref140\/cit140","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2018.00668"},{"key":"ref141\/cit141","doi-asserted-by":"publisher","DOI":"10.1016\/j.phrs.2020.104773"},{"key":"ref142\/cit142","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2018.01472"},{"key":"ref143\/cit143","doi-asserted-by":"publisher","DOI":"10.1038\/srep01543"},{"key":"ref144\/cit144","doi-asserted-by":"publisher","DOI":"10.1016\/j.ebiom.2020.102767"},{"key":"ref145\/cit145","doi-asserted-by":"publisher","DOI":"10.1186\/s12859-016-1415-9"},{"key":"ref146\/cit146","doi-asserted-by":"publisher","DOI":"10.1109\/TCBB.2014.2325031"},{"key":"ref147\/cit147","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-019-09177-y"},{"key":"ref148\/cit148","doi-asserted-by":"publisher","DOI":"10.18632\/oncotarget.10052"},{"key":"ref149\/cit149","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkw335"},{"key":"ref150\/cit150","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.0c00291"},{"key":"ref151\/cit151","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-021-27138-2"},{"key":"ref152\/cit152","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkac377"},{"key":"ref153\/cit153","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkm287"},{"key":"ref154\/cit154","doi-asserted-by":"publisher","DOI":"10.1093\/bioadv\/vbab010"},{"key":"ref155\/cit155","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-020-17189-2"},{"key":"ref156\/cit156","doi-asserted-by":"publisher","DOI":"10.1038\/s41598-020-70239-z"},{"key":"ref157\/cit157","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkab1028"},{"key":"ref158\/cit158","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-023-05905-z"},{"key":"ref159\/cit159","doi-asserted-by":"publisher","DOI":"10.1039\/c2mb00002d"},{"key":"ref160\/cit160","doi-asserted-by":"publisher","DOI":"10.1038\/srep32115"},{"key":"ref161\/cit161","doi-asserted-by":"publisher","DOI":"10.1038\/nature06830"},{"key":"ref162\/cit162","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.0908366106"},{"key":"ref163\/cit163","doi-asserted-by":"publisher","DOI":"10.1038\/srep22955"},{"key":"ref164\/cit164","doi-asserted-by":"publisher","DOI":"10.1016\/j.jff.2021.104848"},{"key":"ref165\/cit165","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pcbi.1003554"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.3c01613","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.3c01613","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2024,1,8]],"date-time":"2024-01-08T09:12:31Z","timestamp":1704705151000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.3c01613"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023,12,27]]},"references-count":166,"journal-issue":{"issue":"1","published-print":{"date-parts":[[2024,1,8]]}},"alternative-id":["10.1021\/acs.jcim.3c01613"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.3c01613","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2023,12,27]]}}}