{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,1,13]],"date-time":"2026-01-13T04:39:32Z","timestamp":1768279172910,"version":"3.49.0"},"reference-count":51,"publisher":"American Chemical Society (ACS)","issue":"21","license":[{"start":{"date-parts":[[2021,4,15]],"date-time":"2021-04-15T00:00:00Z","timestamp":1618444800000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2021,4,15]],"date-time":"2021-04-15T00:00:00Z","timestamp":1618444800000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2021,4,15]],"date-time":"2021-04-15T00:00:00Z","timestamp":1618444800000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/501100002338","name":"Ministry of Education of the People's Republic of China","doi-asserted-by":"publisher","award":["xjj2017029"],"award-info":[{"award-number":["xjj2017029"]}],"id":[{"id":"10.13039\/501100002338","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100002338","name":"Ministry of Education of the People's Republic of China","doi-asserted-by":"publisher","award":["xzy032020038"],"award-info":[{"award-number":["xzy032020038"]}],"id":[{"id":"10.13039\/501100002338","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100002858","name":"China Postdoctoral Science Foundation","doi-asserted-by":"publisher","award":["2017M613147"],"award-info":[{"award-number":["2017M613147"]}],"id":[{"id":"10.13039\/501100002858","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["11774279"],"award-info":[{"award-number":["11774279"]}],"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":["11774280"],"award-info":[{"award-number":["11774280"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100007128","name":"Natural Science Foundation of Shaanxi Province","doi-asserted-by":"publisher","award":["2019JQ-603"],"award-info":[{"award-number":["2019JQ-603"]}],"id":[{"id":"10.13039\/501100007128","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100009996","name":"Shaanxi Province Postdoctoral Science Foundation","doi-asserted-by":"publisher","award":["2017BSHYDZZ44"],"award-info":[{"award-number":["2017BSHYDZZ44"]}],"id":[{"id":"10.13039\/501100009996","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2022,11,14]]},"DOI":"10.1021\/acs.jcim.1c00233","type":"journal-article","created":{"date-parts":[[2021,4,16]],"date-time":"2021-04-16T12:06:39Z","timestamp":1618574799000},"page":"5246-5257","source":"Crossref","is-referenced-by-count":9,"title":["Mechanism of Glycans Modulating Cholesteryl Ester Transfer Protein: Unveiled by Molecular Dynamics Simulation"],"prefix":"10.1021","volume":"62","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-0659-7210","authenticated-orcid":true,"given":"Dongxiao","family":"Hao","sequence":"first","affiliation":[{"name":"MOE Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter, School of Physics, Xi\u2018an Jiaotong University, Xi\u2019an 710049, China"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-8531-8592","authenticated-orcid":true,"given":"He","family":"Wang","sequence":"additional","affiliation":[{"name":"MOE Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter, School of Physics, Xi\u2018an Jiaotong University, Xi\u2019an 710049, China"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-7164-9438","authenticated-orcid":true,"given":"Yongjian","family":"Zang","sequence":"additional","affiliation":[{"name":"MOE Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter, School of Physics, Xi\u2018an Jiaotong University, Xi\u2019an 710049, China"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Lei","family":"Zhang","sequence":"additional","affiliation":[{"name":"MOE Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter, School of Physics, Xi\u2018an Jiaotong University, Xi\u2019an 710049, China"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-6969-8177","authenticated-orcid":true,"given":"Zhiwei","family":"Yang","sequence":"additional","affiliation":[{"name":"MOE Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter, School of Physics, Xi\u2018an Jiaotong University, Xi\u2019an 710049, China"},{"name":"School of Life Science and Technology, Xi\u2018an Jiaotong University, Xi\u2019an 710049, China"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-5866-7591","authenticated-orcid":true,"given":"Shengli","family":"Zhang","sequence":"additional","affiliation":[{"name":"MOE Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter, School of Physics, Xi\u2018an Jiaotong University, Xi\u2019an 710049, China"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2021,4,15]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1016\/0021-9150(76)90126-X"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1016\/0002-9343(77)90874-9"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1038\/nrcardio.2017.156"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1016\/j.cell.2018.08.033"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1021\/bi00070a021"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1016\/S0022-2275(20)36957-1"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1007\/s00018-010-0418-3"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M112.380063"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1042\/BST0391000"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1161\/CIRCRESAHA.117.311978"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1093\/cvr\/cvx240"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.14348\/molcells.2014.0265"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1016\/j.atherosclerosis.2018.09.035"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1038\/nchembio.796"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M116.715565"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M116.744623"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1016\/S0022-2275(20)39830-8"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1038\/nsmb1197"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pcbi.1002299"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1194\/jlr.M054288"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1002\/prot.25520"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1126\/science.abb9983"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.7b00817"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1021\/acscentsci.0c01056"},{"key":"ref25\/cit25","unstructured":"Accelrys\nDiscovery Studio 3.1. http:\/\/accelrys.com (accessed April 2021)."},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1063\/1.445869"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1016\/S0065-3233(03)66002-X"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1021\/ct4010307"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20820"},{"key":"ref30\/cit30","volume-title":"AMBER 2018","author":"Case D. A.","year":"2018"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1002\/bip.360320508"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20290"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1016\/0021-9991(77)90098-5"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1021\/ct400341p"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.5b00331"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btr550"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20084"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpcb.6b01928"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1016\/j.str.2007.10.007"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1002\/prot.24200"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1186\/1471-2105-10-168"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1093\/emboj\/18.3.543"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1128\/JVI.79.10.5963-5970.2005"},{"key":"ref44\/cit44","doi-asserted-by":"publisher","DOI":"10.1007\/s13238-014-0087-3"},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pcbi.1002299"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1002\/(SICI)1097-0282(199803)45:3<177::AID-BIP1>3.0.CO;2-O"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0191157"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1111\/cbdd.13045"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.3389\/fimmu.2018.00910"},{"key":"ref50\/cit50","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.7b00817"},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1038\/srep44578"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.1c00233","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.1c00233","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,25]],"date-time":"2023-04-25T19:11:08Z","timestamp":1682449868000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.1c00233"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2021,4,15]]},"references-count":51,"journal-issue":{"issue":"21","published-print":{"date-parts":[[2022,11,14]]}},"alternative-id":["10.1021\/acs.jcim.1c00233"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.1c00233","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2021,4,15]]}}}