{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,1,15]],"date-time":"2026-01-15T13:31:18Z","timestamp":1768483878586,"version":"3.49.0"},"reference-count":64,"publisher":"Informa UK Limited","issue":"22","funder":[{"name":"DST, New Delhi, India"},{"name":"SERB, India."}],"content-domain":{"domain":["www.tandfonline.com"],"crossmark-restriction":true},"short-container-title":["Journal of Biomolecular Structure and Dynamics"],"published-print":{"date-parts":[[2022,12,12]]},"DOI":"10.1080\/07391102.2021.1967786","type":"journal-article","created":{"date-parts":[[2021,8,23]],"date-time":"2021-08-23T14:47:19Z","timestamp":1629730039000},"page":"12088-12099","update-policy":"https:\/\/doi.org\/10.1080\/tandf_crossmark_01","source":"Crossref","is-referenced-by-count":4,"title":["Venetoclax: a promising repurposed drug against SARS-CoV-2 main protease"],"prefix":"10.1080","volume":"40","author":[{"given":"Suvankar","family":"Ghosh","sequence":"first","affiliation":[{"name":"Department of Biosciences and Bioengineering, Indian Institute of Technology Guwahati, Guwahati, India"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Debojit","family":"Bhattacherjee","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Indian Institute of Technology Guwahati, Guwahati, India"},{"name":"Centre for the Environment, Indian Institute of Technology Guwahati, Guwahati, India"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-0391-3580","authenticated-orcid":false,"given":"Priyadarshi","family":"Satpati","sequence":"additional","affiliation":[{"name":"Department of Biosciences and Bioengineering, Indian Institute of Technology Guwahati, Guwahati, India"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-9115-7561","authenticated-orcid":false,"given":"Krishna Pada","family":"Bhabak","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Indian Institute of Technology Guwahati, Guwahati, India"},{"name":"Centre for the Environment, Indian Institute of Technology Guwahati, Guwahati, India"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"301","published-online":{"date-parts":[[2021,8,23]]},"reference":[{"issue":"1","key":"CIT0001","volume":"11","author":"Vuong W.","year":"2020","journal-title":"Nature Communications"},{"key":"CIT0002","doi-asserted-by":"publisher","DOI":"10.3390\/molecules25173920"},{"key":"CIT0003","doi-asserted-by":"publisher","DOI":"10.1093\/emboj\/cdf327"},{"key":"CIT0004","doi-asserted-by":"publisher","DOI":"10.1039\/C8OB01891J"},{"key":"CIT0005","doi-asserted-by":"publisher","DOI":"10.1063\/1.448118"},{"key":"CIT0006","doi-asserted-by":"publisher","DOI":"10.1002\/chem.200601584"},{"key":"CIT0007","doi-asserted-by":"publisher","DOI":"10.1002\/slct.201700499"},{"key":"CIT0008","doi-asserted-by":"publisher","DOI":"10.1039\/C9CC05562B"},{"key":"CIT0009","doi-asserted-by":"publisher","DOI":"10.3390\/ijms21093099"},{"key":"CIT0010","doi-asserted-by":"publisher","DOI":"10.2144\/btn-2020-0038"},{"key":"CIT0011","doi-asserted-by":"publisher","DOI":"10.1126\/science.abb4489"},{"key":"CIT0012","doi-asserted-by":"publisher","DOI":"10.1063\/1.464397"},{"key":"CIT0013","unstructured":"Dassault Syst\u00e8mes BIOVIA. (2016).Discovery studio modeling environment, Release 2017. Dassault Syst\u00e8mes."},{"key":"CIT0014","doi-asserted-by":"publisher","DOI":"10.1016\/j.ab.2005.04.027"},{"key":"CIT0015","unstructured":"Favipiravir, protease inhibitors, oseltamivir -Gpo, hydroxychloroquine for treatment of COVID-19 - Full Text View - ClinicalTrials.gov. https:\/\/clinicaltrials.gov\/ct2\/show\/NCT04303299?cond=protease+inhibitors+covid-19&draw=2"},{"key":"CIT0016","doi-asserted-by":"publisher","DOI":"10.1517\/17460441.2015.1032936"},{"key":"CIT0017","doi-asserted-by":"publisher","DOI":"10.1002\/cmdc.202000223"},{"key":"CIT0018","doi-asserted-by":"publisher","DOI":"10.1021\/acscombsci.0c00058"},{"key":"CIT0019","doi-asserted-by":"publisher","DOI":"10.1016\/j.virusres.2007.02.015"},{"key":"CIT0020","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2018.01089"},{"key":"CIT0021","doi-asserted-by":"publisher","DOI":"10.1007\/BF00941484"},{"key":"CIT0022","doi-asserted-by":"publisher","DOI":"10.1002\/(SICI)1096-987X(199709)18:12<1463::AID-JCC4>3.0.CO;2-H"},{"key":"CIT0023","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M502556200"},{"key":"CIT0024","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-020-2223-y"},{"key":"CIT0025","doi-asserted-by":"publisher","DOI":"10.1038\/s41594-020-0440-6"},{"key":"CIT0026","doi-asserted-by":"publisher","DOI":"10.1063\/1.445869"},{"key":"CIT0027","doi-asserted-by":"publisher","DOI":"10.3390\/molecules20021984"},{"key":"CIT0028","doi-asserted-by":"publisher","DOI":"10.1021\/ci500020m"},{"key":"CIT0029","doi-asserted-by":"publisher","DOI":"10.1002\/cben.201400031"},{"key":"CIT0030","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa2001316"},{"key":"CIT0031","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.2010470117"},{"key":"CIT0032","doi-asserted-by":"publisher","DOI":"10.1016\/j.abb.2008.01.023"},{"key":"CIT0033","doi-asserted-by":"publisher","DOI":"10.1038\/s41421-020-0156-0"},{"key":"CIT0034","doi-asserted-by":"publisher","DOI":"10.1039\/D0CC00613K"},{"key":"CIT0035","doi-asserted-by":"publisher","DOI":"10.1126\/sciadv.abd0345"},{"key":"CIT0036","doi-asserted-by":"crossref","unstructured":"Owen, C. D., Lukacik, P., Strain-Damerell, C. M., Douangamath, A., Powell, A. J., Fearon, D., Brandao-Neto, J., Crawshaw, A. D., Aragao, D., Williams, M., Flaig, R., Hall, D. R., McAuley, K. E., Mazzorana, M., Stuart, D. I., von Delft, F. & Walsh, M. A. (2020).SARS-CoV-2 main protease with unliganded active site (2019-nCoV, coronavirus disease 2019, COVID-19). https:\/\/www.rcsb.org\/structure\/6Y84","DOI":"10.2210\/pdb6yb7\/pdb"},{"key":"CIT0037","doi-asserted-by":"crossref","first-page":"4353","DOI":"10.1111\/bph.15204","author":"Penman S. L.","year":"2020","journal-title":"British Journal of Pharmacology"},{"key":"CIT0038","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.5b01461"},{"key":"CIT0039","doi-asserted-by":"publisher","DOI":"10.1016\/S0140-6736(20)30304-4"},{"key":"CIT0040","doi-asserted-by":"publisher","DOI":"10.1016\/j.tifs.2020.08.006"},{"key":"CIT0041","doi-asserted-by":"publisher","DOI":"10.1038\/s41589-020-00689-z"},{"key":"CIT0042","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmc.2010.09.035"},{"key":"CIT0043","doi-asserted-by":"publisher","DOI":"10.1007\/s41061-018-0184-5"},{"key":"CIT0044","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-019-13940-6"},{"key":"CIT0045","doi-asserted-by":"publisher","DOI":"10.1186\/s43141-020-00085-z"},{"key":"CIT0046","doi-asserted-by":"publisher","DOI":"10.1016\/j.cplett.2020.138193"},{"key":"CIT0047","doi-asserted-by":"publisher","DOI":"10.1021\/acsomega.0c00772"},{"issue":"2","key":"CIT0048","doi-asserted-by":"crossref","first-page":"455","DOI":"10.1002\/jcc.21334","volume":"31","author":"Trott O.","year":"2010","journal-title":"Journal of Computational Chemistry"},{"key":"CIT0049","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20291"},{"issue":"4","key":"CIT0050","doi-asserted-by":"crossref","first-page":"671","DOI":"10.1002\/jcc.21367","volume":"31","author":"Vanommeslaeghe K.","year":"2010","journal-title":"Journal of Computational Chemistry"},{"key":"CIT0051","doi-asserted-by":"publisher","DOI":"10.1021\/ci3003649"},{"key":"CIT0052","doi-asserted-by":"publisher","DOI":"10.3389\/fmolb.2017.00087"},{"key":"CIT0053","doi-asserted-by":"publisher","DOI":"10.1021\/acs.chemrev.9b00055"},{"key":"CIT0054","volume":"6","author":"Wang F.","year":"2016","journal-title":"Scientific Reports"},{"key":"CIT0055","doi-asserted-by":"publisher","DOI":"10.1016\/j.bbrc.2005.11.102"},{"key":"CIT0056","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-020-2008-3"},{"key":"CIT0057","doi-asserted-by":"publisher","DOI":"10.1107\/S1744309105033257"},{"key":"CIT0058","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pbio.0030324"},{"key":"CIT0059","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.1835675100"},{"key":"CIT0060","doi-asserted-by":"publisher","DOI":"10.1126\/science.abb3405"},{"key":"CIT0061","doi-asserted-by":"publisher","DOI":"10.2174\/1568026616666161117112604"},{"key":"CIT0062","doi-asserted-by":"publisher","DOI":"10.1128\/JVI.00298-08"},{"key":"CIT0063","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-020-2012-7"},{"key":"CIT0064","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa2001017"}],"container-title":["Journal of Biomolecular Structure and Dynamics"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/www.tandfonline.com\/doi\/pdf\/10.1080\/07391102.2021.1967786","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,11,7]],"date-time":"2023-11-07T19:08:48Z","timestamp":1699384128000},"score":1,"resource":{"primary":{"URL":"https:\/\/www.tandfonline.com\/doi\/full\/10.1080\/07391102.2021.1967786"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2021,8,23]]},"references-count":64,"journal-issue":{"issue":"22","published-print":{"date-parts":[[2022,12,12]]}},"alternative-id":["10.1080\/07391102.2021.1967786"],"URL":"https:\/\/doi.org\/10.1080\/07391102.2021.1967786","relation":{},"ISSN":["0739-1102","1538-0254"],"issn-type":[{"value":"0739-1102","type":"print"},{"value":"1538-0254","type":"electronic"}],"subject":[],"published":{"date-parts":[[2021,8,23]]},"assertion":[{"value":"The publishing and review policy for this title is described in its Aims & Scope.","order":1,"name":"peerreview_statement","label":"Peer Review Statement"},{"value":"http:\/\/www.tandfonline.com\/action\/journalInformation?show=aimsScope&journalCode=tbsd20","URL":"http:\/\/www.tandfonline.com\/action\/journalInformation?show=aimsScope&journalCode=tbsd20","order":2,"name":"aims_and_scope_url","label":"Aim & Scope"},{"value":"2021-02-03","order":0,"name":"received","label":"Received","group":{"name":"publication_history","label":"Publication History"}},{"value":"2021-08-09","order":2,"name":"accepted","label":"Accepted","group":{"name":"publication_history","label":"Publication History"}},{"value":"2021-08-23","order":3,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}]}}