{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,8,29]],"date-time":"2025-08-29T09:57:55Z","timestamp":1756461475944,"version":"3.40.5"},"reference-count":48,"publisher":"Informa UK Limited","issue":"8","content-domain":{"domain":["www.tandfonline.com"],"crossmark-restriction":true},"short-container-title":["Journal of Biomolecular Structure and Dynamics"],"published-print":{"date-parts":[[2024,5,23]]},"DOI":"10.1080\/07391102.2023.2220809","type":"journal-article","created":{"date-parts":[[2023,6,8]],"date-time":"2023-06-08T11:27:48Z","timestamp":1686223668000},"page":"4344-4355","update-policy":"https:\/\/doi.org\/10.1080\/tandf_crossmark_01","source":"Crossref","is-referenced-by-count":2,"title":["Identification of potential anti-mucor agents by targeting endothelial cell receptor glucose-regulated protein-78 using\n            <i>in silico<\/i>\n            approach"],"prefix":"10.1080","volume":"42","author":[{"given":"Anamika","family":"Singh","sequence":"first","affiliation":[{"name":"Department of Biophysics, All India Institute of Medical Sciences, New Delhi, India"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Ashwin","family":"Varadarajan","sequence":"additional","affiliation":[{"name":"Department of Medicine, All India Institute of Medical Sciences, New Delhi, India"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3890-1958","authenticated-orcid":false,"given":"Pradeep","family":"Pant","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Indian Institute of Technology, New Delhi, India"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Tej P.","family":"Singh","sequence":"additional","affiliation":[{"name":"Department of Biophysics, All India Institute of Medical Sciences, New Delhi, India"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Naval K.","family":"Vikram","sequence":"additional","affiliation":[{"name":"Department of Medicine, All India Institute of Medical Sciences, New Delhi, India"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Sujata","family":"Sharma","sequence":"additional","affiliation":[{"name":"Department of Biophysics, All India Institute of Medical Sciences, New Delhi, India"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3826-8064","authenticated-orcid":false,"given":"Pradeep","family":"Sharma","sequence":"additional","affiliation":[{"name":"Department of Biophysics, All India Institute of Medical Sciences, New Delhi, India"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"301","published-online":{"date-parts":[[2023,6,8]]},"reference":[{"key":"e_1_3_3_2_1","doi-asserted-by":"publisher","DOI":"10.1021\/cr040426m"},{"key":"e_1_3_3_3_1","doi-asserted-by":"publisher","DOI":"10.1016\/B978-0-12-812351-5.00004-0"},{"key":"e_1_3_3_4_1","doi-asserted-by":"publisher","DOI":"10.1177\/1177932220965505"},{"key":"e_1_3_3_5_1","doi-asserted-by":"publisher","DOI":"10.1128\/mBio.01087-20"},{"key":"e_1_3_3_6_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ijid.2009.11.024"},{"key":"e_1_3_3_7_1","volume-title":"AMBER14","author":"Case D. A.","year":"2014","unstructured":"Case, D. A., Babin, V., Berryman, J. T., Betz, R. M., Cai, Q., Cerutti, D. S., Cheatham, T. E., Iii; Darden, T. A., Duke, R. E., Gohlke, H., Goetz, A. W., Gusarov, S., Homeyer, N., Janowski, P., Kaus, J., Kolossv\u00e1ry, I., Kovalenko, A., Lee, T. S., LeGrand, S., \u2026 Kollman, P. A. (2014). AMBER14. University of California."},{"key":"e_1_3_3_8_1","doi-asserted-by":"publisher","DOI":"10.1080\/13693780500464930"},{"key":"e_1_3_3_9_1","doi-asserted-by":"publisher","DOI":"10.1053\/jinf.2001.0831"},{"key":"e_1_3_3_10_1","doi-asserted-by":"publisher","DOI":"10.1021\/ja00119a045"},{"key":"e_1_3_3_11_1","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.540161106"},{"key":"e_1_3_3_12_1","doi-asserted-by":"publisher","DOI":"10.1007\/978-1-4939-2269-7_19"},{"key":"e_1_3_3_13_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.chemrev.0c00534"},{"key":"e_1_3_3_14_1","unstructured":"Discovery Studio Visualizer Software. (2012). Version 4.0. http:\/\/www.accelrys.com"},{"key":"e_1_3_3_15_1","doi-asserted-by":"publisher","DOI":"10.1146\/annurev-biophys-042910-155245"},{"key":"e_1_3_3_16_1","doi-asserted-by":"publisher","DOI":"10.3389\/fchem.2019.00540"},{"key":"e_1_3_3_17_1","doi-asserted-by":"publisher","DOI":"10.2174\/15734099113096660036"},{"key":"e_1_3_3_18_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.lfs.2020.118317"},{"key":"e_1_3_3_19_1","doi-asserted-by":"publisher","DOI":"10.1021\/jm0306430"},{"key":"e_1_3_3_20_1","doi-asserted-by":"publisher","DOI":"10.1172\/JCI71349"},{"key":"e_1_3_3_21_1","doi-asserted-by":"publisher","DOI":"10.1038\/355033a0"},{"key":"e_1_3_3_22_1","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.10379"},{"key":"e_1_3_3_23_1","doi-asserted-by":"publisher","DOI":"10.1016\/B978-0-12-812351-5.00002-7"},{"key":"e_1_3_3_24_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.neuron.2018.08.011"},{"key":"e_1_3_3_25_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.lfs.2019.04.022"},{"key":"e_1_3_3_26_1","doi-asserted-by":"publisher","DOI":"10.1021\/jp8001614"},{"key":"e_1_3_3_27_1","doi-asserted-by":"publisher","DOI":"10.1021\/ci200227u"},{"key":"e_1_3_3_28_1","doi-asserted-by":"publisher","DOI":"10.3390\/ijms21176339"},{"key":"e_1_3_3_29_1","doi-asserted-by":"publisher","DOI":"10.1172\/JCI42164"},{"key":"e_1_3_3_30_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.5b00255"},{"key":"e_1_3_3_31_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cellsig.2004.01.003"},{"key":"e_1_3_3_32_1","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21256"},{"key":"e_1_3_3_33_1","doi-asserted-by":"publisher","DOI":"10.1021\/jp994072s"},{"key":"e_1_3_3_34_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bbrc.2020.08.097"},{"key":"e_1_3_3_35_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bpc.2020.106525"},{"key":"e_1_3_3_36_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bbrc.2019.05.051"},{"key":"e_1_3_3_37_1","doi-asserted-by":"publisher","DOI":"10.1080\/07391102.2019.1585292"},{"key":"e_1_3_3_38_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpcb.0c10553"},{"key":"e_1_3_3_39_1","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gku855"},{"key":"e_1_3_3_40_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ceb.2010.09.007"},{"key":"e_1_3_3_41_1","doi-asserted-by":"publisher","DOI":"10.1021\/ct400341p"},{"key":"e_1_3_3_42_1","doi-asserted-by":"publisher","DOI":"10.1021\/ct700119m"},{"key":"e_1_3_3_43_1","doi-asserted-by":"publisher","DOI":"10.1093\/mmy\/myx101"},{"key":"e_1_3_3_44_1","doi-asserted-by":"publisher","DOI":"10.4103\/ijo.IJO_1316_21"},{"key":"e_1_3_3_45_1","doi-asserted-by":"publisher","DOI":"10.1016\/S0006-3495(03)74962-5"},{"key":"e_1_3_3_46_1","unstructured":"The PyMOL Molecular Graphics System. Version 1.2r3pre Schr\u00f6dinger LLC."},{"key":"e_1_3_3_47_1","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkr288"},{"key":"e_1_3_3_48_1","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkj067"},{"key":"e_1_3_3_49_1","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkab255"}],"container-title":["Journal of Biomolecular Structure and Dynamics"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/www.tandfonline.com\/doi\/pdf\/10.1080\/07391102.2023.2220809","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2024,4,25]],"date-time":"2024-04-25T07:53:52Z","timestamp":1714031632000},"score":1,"resource":{"primary":{"URL":"https:\/\/www.tandfonline.com\/doi\/full\/10.1080\/07391102.2023.2220809"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023,6,8]]},"references-count":48,"journal-issue":{"issue":"8","published-print":{"date-parts":[[2024,5,23]]}},"alternative-id":["10.1080\/07391102.2023.2220809"],"URL":"https:\/\/doi.org\/10.1080\/07391102.2023.2220809","relation":{},"ISSN":["0739-1102","1538-0254"],"issn-type":[{"type":"print","value":"0739-1102"},{"type":"electronic","value":"1538-0254"}],"subject":[],"published":{"date-parts":[[2023,6,8]]},"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":"2022-12-22","order":0,"name":"received","label":"Received","group":{"name":"publication_history","label":"Publication History"}},{"value":"2023-05-28","order":1,"name":"accepted","label":"Accepted","group":{"name":"publication_history","label":"Publication History"}},{"value":"2023-06-08","order":2,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}]}}