{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,4,18]],"date-time":"2026-04-18T15:19:27Z","timestamp":1776525567548,"version":"3.51.2"},"reference-count":40,"publisher":"American Chemical Society (ACS)","issue":"7","license":[{"start":{"date-parts":[[2026,3,27]],"date-time":"2026-03-27T00:00:00Z","timestamp":1774569600000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"funder":[{"DOI":"10.13039\/100000057","name":"National Institute of General Medical Sciences","doi-asserted-by":"publisher","award":["R35 GM153458"],"award-info":[{"award-number":["R35 GM153458"]}],"id":[{"id":"10.13039\/100000057","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2026,4,13]]},"DOI":"10.1021\/acs.jcim.6c00111","type":"journal-article","created":{"date-parts":[[2026,3,27]],"date-time":"2026-03-27T15:12:28Z","timestamp":1774624348000},"page":"3416-3423","source":"Crossref","is-referenced-by-count":1,"title":["CHARMM-GUI\n                    <i>Ligand Docker<\/i>\n                    for Molecular Docking with Various Docking Programs"],"prefix":"10.1021","volume":"66","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-7478-4579","authenticated-orcid":true,"given":"Donghyuk","family":"Suh","sequence":"first","affiliation":[{"name":"Department of Biological Sciences","place":["Bethlehem, United States"]},{"name":"Lehigh University","place":["Bethlehem, United States"]}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0009-0007-8767-6001","authenticated-orcid":true,"given":"Gyusik","family":"Kim","sequence":"additional","affiliation":[{"name":"Department of Industrial Pharmacy","place":["Seoul, Republic of Korea"]},{"name":"Dongguk University","place":["Seoul, Republic of Korea"]}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-5642-6041","authenticated-orcid":true,"given":"Wonpil","family":"Im","sequence":"additional","affiliation":[{"name":"Department of Biological Sciences","place":["Bethlehem, United States"]},{"name":"Lehigh University","place":["Bethlehem, United States"]}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2026,3,27]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1016\/0022-2836(82)90153-X"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1038\/nrd1549"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1021\/jp973084f"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21367"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1038\/nmeth.4067"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1021\/ja00124a002"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1021\/ja9621760"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1021\/jm050436v"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1021\/ci400045v"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1002\/prot.10465"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21334"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pcbi.1003571"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.48550\/arXiv.2210.01776"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.0c01006"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.23905"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.4c01691"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20945"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1021\/ci300604z"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1039\/D3SC04185A"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.0c00057"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1002\/pro.4413"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1016\/bs.apcsb.2014.06.002"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1016\/j.jmb.2023.167995"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1016\/j.jmb.2024.168554"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-021-03819-2"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-024-07487-w"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1145\/2945292.2945324"},{"key":"ref28\/cit28","author":"ChemAxon","journal-title":"Marvin JS was used for drawing"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.1c01156"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.4c00439"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.8b00312"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1016\/j.jmgm.2020.107532"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.1711"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.1c00136"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.8b00545"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.23354"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20035"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1016\/j.softx.2015.06.001"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1002\/bimj.200410135"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1021\/jm0309957"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.6c00111","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.6c00111","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,4,13]],"date-time":"2026-04-13T12:23:10Z","timestamp":1776082990000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.6c00111"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,3,27]]},"references-count":40,"journal-issue":{"issue":"7","published-print":{"date-parts":[[2026,4,13]]}},"alternative-id":["10.1021\/acs.jcim.6c00111"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.6c00111","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2026,3,27]]}}}