{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,4,2]],"date-time":"2026-04-02T09:35:59Z","timestamp":1775122559995,"version":"3.50.1"},"reference-count":29,"publisher":"American Chemical Society (ACS)","issue":"10","funder":[{"DOI":"10.13039\/501100003512","name":"State Administration of Foreign Experts Affairs","doi-asserted-by":"publisher","id":[{"id":"10.13039\/501100003512","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","id":[{"id":"10.13039\/501100002338","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100005230","name":"Natural Science Foundation of Chongqing","doi-asserted-by":"publisher","award":["2013jcyjA10063"],"award-info":[{"award-number":["2013jcyjA10063"]}],"id":[{"id":"10.13039\/501100005230","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2016,10,24]]},"DOI":"10.1021\/acs.jcim.6b00326","type":"journal-article","created":{"date-parts":[[2016,9,14]],"date-time":"2016-09-14T05:12:53Z","timestamp":1473829973000},"page":"2061-2068","source":"Crossref","is-referenced-by-count":26,"title":["Constructing Interconsistent, Reasonable, and Predictive Models for Both the Kinetic and Thermodynamic Properties of HIV-1 Protease Inhibitors"],"prefix":"10.1021","volume":"56","author":[{"given":"Sujun","family":"Qu","sequence":"first","affiliation":[{"name":"Key\rLaboratory of Biorheological Science and Technology, Ministry of Education, Chongqing University, Chongqing 400044, China"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Shuheng","family":"Huang","sequence":"additional","affiliation":[{"name":"College\rof Bioengineering, Chongqing University, Chongqing 400044, China"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Xianchao","family":"Pan","sequence":"additional","affiliation":[{"name":"College\rof Bioengineering, Chongqing University, Chongqing 400044, China"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Li","family":"Yang","sequence":"additional","affiliation":[{"name":"Key\rLaboratory of Biorheological Science and Technology, Ministry of Education, Chongqing University, Chongqing 400044, China"},{"name":"College\rof Bioengineering, Chongqing University, Chongqing 400044, China"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Hu","family":"Mei","sequence":"additional","affiliation":[{"name":"Key\rLaboratory of Biorheological Science and Technology, Ministry of Education, Chongqing University, Chongqing 400044, China"},{"name":"College\rof Bioengineering, Chongqing University, Chongqing 400044, China"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2016,9,30]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.85.13.4686"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1016\/j.biocel.2004.02.015"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1016\/j.ijantimicag.2008.10.010"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1038\/nrd2082"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1016\/j.drudis.2013.02.010"},{"key":"ref6\/cit6","volume-title":"Chemical Kinetic Methods: Principles of Fast Reaction Techniques and Applications","author":"Kalidas C.","year":"2005"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1016\/S0959-440X(00)00248-7"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1021\/bm801376v"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1002\/jcph.298"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1016\/j.bios.2012.08.049"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.2174\/1381612811319230009"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1134\/S1990750812010039"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1016\/j.jpba.2015.01.042"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1002\/cbdv.200900117"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1038\/nprot.2011.305"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1023\/B:JCAM.0000021882.99270.4c"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1016\/j.jmgm.2010.05.009"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1021\/ct4007037"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0019268"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1002\/cem.1010"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.2174\/0929867033457070"},{"key":"ref22\/cit22","volume-title":"Comprehensive Summaries of Uppsala Dissertations from the Faculty of Pharmacy","volume":"263","author":"Schaal W.","year":"2002"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.5b00632"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1021\/jm0499110"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1021\/jm0208370"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1038\/nrd1032"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1016\/j.ejmech.2010.12.024"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1016\/j.ejmech.2008.07.002"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1016\/0003-2670(86)80028-9"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.6b00326","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,24]],"date-time":"2023-04-24T07:18:28Z","timestamp":1682320708000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.6b00326"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2016,9,30]]},"references-count":29,"journal-issue":{"issue":"10","published-print":{"date-parts":[[2016,10,24]]}},"alternative-id":["10.1021\/acs.jcim.6b00326"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.6b00326","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2016,9,30]]}}}