{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,6,25]],"date-time":"2026-06-25T08:42:16Z","timestamp":1782376936978,"version":"3.54.5"},"reference-count":86,"publisher":"American Chemical Society (ACS)","issue":"18","license":[{"start":{"date-parts":[[2022,9,15]],"date-time":"2022-09-15T00:00:00Z","timestamp":1663200000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2022,9,15]],"date-time":"2022-09-15T00:00:00Z","timestamp":1663200000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2022,9,15]],"date-time":"2022-09-15T00:00:00Z","timestamp":1663200000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/100007472","name":"University of Kentucky","doi-asserted-by":"publisher","id":[{"id":"10.13039\/100007472","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000001","name":"National Science Foundation","doi-asserted-by":"publisher","award":["DMS-2053284"],"award-info":[{"award-number":["DMS-2053284"]}],"id":[{"id":"10.13039\/100000001","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000001","name":"National Science Foundation","doi-asserted-by":"publisher","award":["DMS-2151802"],"award-info":[{"award-number":["DMS-2151802"]}],"id":[{"id":"10.13039\/100000001","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2022,9,26]]},"DOI":"10.1021\/acs.jcim.2c00697","type":"journal-article","created":{"date-parts":[[2022,9,15]],"date-time":"2022-09-15T20:12:54Z","timestamp":1663272774000},"page":"4329-4341","source":"Crossref","is-referenced-by-count":11,"title":["EISA-Score: Element Interactive Surface Area Score for Protein\u2013Ligand Binding Affinity Prediction"],"prefix":"10.1021","volume":"62","author":[{"given":"Md Masud","family":"Rana","sequence":"first","affiliation":[{"name":"Department of Mathematics, University of Kentucky, Lexington, Kentucky 40506, United States"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-2215-0328","authenticated-orcid":true,"given":"Duc Duy","family":"Nguyen","sequence":"additional","affiliation":[{"name":"Department of Mathematics, University of Kentucky, Lexington, Kentucky 40506, United States"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2022,9,15]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1016\/j.sbi.2005.02.001"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btq112"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1007\/s00285-008-0226-7"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.48550\/arXiv.q-bio\/0610038"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20796"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1021\/jm020986i"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pcbi.1005929"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1515\/mlbmb-2015-0009"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btu104"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1002\/(SICI)1096-987X(199808)19:11<1268::AID-JCC6>3.0.CO;2-I"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21646"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1002\/cnm.1458"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1063\/1.3698598"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.4208\/cicp.050511.050811s"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21646"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1016\/j.jcp.2010.06.036"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1007\/s00285-011-0402-z"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1063\/1.3660212"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1063\/1.4745084"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1021\/ci9000053"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1016\/0263-7855(85)80009-6"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1063\/1.1770803"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1002\/prot.20417"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1177\/1094342016647114"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1021\/ci900317x"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1021\/acsomega.1c04996"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1016\/j.jmb.2004.08.035"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1145\/174462.156635"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1016\/j.jcp.2018.07.035"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1023\/A:1007996124545"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1002\/(SICI)1096-987X(199802)19:3<319::AID-JCC6>3.0.CO;2-W"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1039\/D0CP00305K"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1016\/j.jcp.2010.09.031"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1021\/j100011a016"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.1032"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1039\/b707574j"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20125"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1007\/s00371-017-1397-2"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1002\/bip.360030606"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1080\/00268976.2019.1644384"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1016\/0022-2836(71)90324-X"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1021\/ci300493w"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1186\/1471-2105-15-291"},{"key":"ref44\/cit44","doi-asserted-by":"publisher","DOI":"10.1002\/minf.201400132"},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1021\/ct400065j"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1021\/ci500081m"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1002\/(SICI)1097-0134(19981001)33:1<1::AID-PROT1>3.0.CO;2-O"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.24682"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1137\/16M1099704"},{"key":"ref50\/cit50","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pcbi.1009943"},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbaa411"},{"key":"ref52\/cit52","doi-asserted-by":"publisher","DOI":"10.1126\/sciadv.abc5329"},{"key":"ref53\/cit53","doi-asserted-by":"publisher","DOI":"10.1016\/j.cam.2016.08.019"},{"key":"ref54\/cit54","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.24757"},{"key":"ref55\/cit55","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.24512"},{"key":"ref56\/cit56","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.9b00334"},{"key":"ref57\/cit57","doi-asserted-by":"publisher","DOI":"10.1002\/cnm.3179"},{"key":"ref58\/cit58","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.7b00226"},{"key":"ref59\/cit59","doi-asserted-by":"publisher","DOI":"10.1063\/1.4922045"},{"key":"ref60\/cit60","doi-asserted-by":"publisher","DOI":"10.1016\/S0076-6879(03)74021-X"},{"key":"ref61\/cit61","doi-asserted-by":"publisher","DOI":"10.1146\/annurev.bb.06.060177.001055"},{"key":"ref62\/cit62","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20550"},{"key":"ref63\/cit63","doi-asserted-by":"publisher","DOI":"10.1002\/(SICI)1097-0282(199603)38:3<305::AID-BIP4>3.0.CO;2-Y"},{"key":"ref64\/cit64","doi-asserted-by":"publisher","DOI":"10.1016\/j.jcp.2005.05.005"},{"key":"ref65\/cit65","doi-asserted-by":"publisher","DOI":"10.1002\/(SICI)1097-0134(199605)25:1<120::AID-PROT10>3.3.CO;2-1"},{"key":"ref66\/cit66","doi-asserted-by":"publisher","DOI":"10.1126\/science.8303294"},{"key":"ref67\/cit67","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/bty374"},{"key":"ref68\/cit68","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.8b00545"},{"key":"ref69\/cit69","doi-asserted-by":"publisher","DOI":"10.1093\/protein\/8.7.677"},{"key":"ref70\/cit70","doi-asserted-by":"publisher","DOI":"10.1016\/S0006-3495(97)78105-0"},{"key":"ref71\/cit71","doi-asserted-by":"publisher","DOI":"10.1063\/1.4932342"},{"key":"ref72\/cit72","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.24667"},{"key":"ref73\/cit73","doi-asserted-by":"publisher","DOI":"10.1002\/prot.24935"},{"key":"ref74\/cit74","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbab136"},{"key":"ref75\/cit75","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.0c01415"},{"key":"ref76\/cit76","doi-asserted-by":"publisher","DOI":"10.1142\/S021963361341006X"},{"key":"ref77\/cit77","doi-asserted-by":"publisher","DOI":"10.48550\/arXiv.math-ph\/0511001"},{"key":"ref78\/cit78","doi-asserted-by":"publisher","DOI":"10.1137\/110845690"},{"key":"ref79\/cit79","doi-asserted-by":"publisher","DOI":"10.1063\/1.4830404"},{"key":"ref80\/cit80","doi-asserted-by":"publisher","DOI":"10.48550\/arXiv.1612.01735"},{"key":"ref81\/cit81","doi-asserted-by":"publisher","DOI":"10.1063\/1.4931733"},{"key":"ref82\/cit82","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0008140"},{"key":"ref83\/cit83","doi-asserted-by":"publisher","DOI":"10.1016\/j.jmgm.2008.01.007"},{"key":"ref84\/cit84","doi-asserted-by":"publisher","DOI":"10.1016\/j.jcp.2011.03.020"},{"key":"ref85\/cit85","doi-asserted-by":"publisher","DOI":"10.1063\/1.3581031"},{"key":"ref86\/cit86","doi-asserted-by":"publisher","DOI":"10.1021\/ci2000665"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.2c00697","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.2c00697","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,27]],"date-time":"2023-04-27T05:02:32Z","timestamp":1682571752000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.2c00697"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2022,9,15]]},"references-count":86,"journal-issue":{"issue":"18","published-print":{"date-parts":[[2022,9,26]]}},"alternative-id":["10.1021\/acs.jcim.2c00697"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.2c00697","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2022,9,15]]}}}