{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,23]],"date-time":"2026-10-23T19:56:41Z","timestamp":1792785401431,"version":"4.5.0"},"reference-count":38,"publisher":"Informa UK Limited","license":[{"start":{"date-parts":[[2026,9,26]],"date-time":"2026-09-26T00:00:00Z","timestamp":1790380800000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/doi.org\/10.1080\/policies-text-data-mining"}],"funder":[{"name":"Deanship of Scientific Research, Vice Presidency for Graduate Studies and Scientific Research, King Faisal University, Saudi Arabia","award":["KFU265054"],"award-info":[{"award-number":["KFU265054"]}],"id":[{"id":"https:\/\/ror.org\/00dn43547","id-type":"ROR","asserted-by":"crossref"}]}],"content-domain":{"domain":["www.tandfonline.com"],"crossmark-restriction":true},"short-container-title":["Journal of Receptors and Signal Transduction"],"DOI":"10.1080\/10799893.2026.2737641","type":"journal-article","created":{"date-parts":[[2026,9,26]],"date-time":"2026-09-26T12:24:48Z","timestamp":1790425488000},"page":"1-16","update-policy":"https:\/\/doi.org\/10.1080\/tandf_crossmark_01","source":"Crossref","is-referenced-by-count":0,"title":["Conformational energy basin mapping and quantum interaction profiling reveal a persistent KRAS-bound small molecule with enhanced binding stability"],"prefix":"10.1080","author":[{"given":"Vivek Dhar","family":"Dwivedi","sequence":"first","affiliation":[{"name":"Department of Physiology, Saveetha Medical College and Hospital, Saveetha Institute of Medical and Technical Sciences","place":["Chennai, India"]},{"name":"Bioinformatics Research Division, Quanta Calculus","place":["Greater Noida, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mohd","family":"Saeed","sequence":"additional","affiliation":[{"name":"Department of Biology, College of Science, University of Hail","place":["Hail, Saudi Arabia"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-0088-0565","authenticated-orcid":false,"given":"Mohammad Amjad","family":"Kamal","sequence":"additional","affiliation":[{"name":"Future Technologies Research Centre, King Faisal University","place":["Al Ahsa, Saudi Arabia"]},{"name":"Novel Global Community Educational Foundation","place":["Sydney, Australia"]}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"301","published-online":{"date-parts":[[2026,9,26]]},"reference":[{"key":"e_1_3_4_2_1","doi-asserted-by":"publisher","DOI":"10.1158\/0008-5472.CAN-19-3682"},{"key":"e_1_3_4_3_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41573-020-0068-6"},{"key":"e_1_3_4_4_1","doi-asserted-by":"publisher","DOI":"10.1101\/cshperspect.a031435"},{"key":"e_1_3_4_5_1","doi-asserted-by":"publisher","DOI":"10.3389\/fmed.2024.1369136"},{"key":"e_1_3_4_6_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cell.2017.06.009"},{"key":"e_1_3_4_7_1","doi-asserted-by":"publisher","DOI":"10.3390\/biology15141149"},{"key":"e_1_3_4_8_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41568-019-0123-y"},{"key":"e_1_3_4_9_1","doi-asserted-by":"publisher","DOI":"10.3390\/cells13141221"},{"key":"e_1_3_4_10_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.4c01174"},{"key":"e_1_3_4_11_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpcb.5c07583"},{"key":"e_1_3_4_12_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cbpa.2021.02.010"},{"key":"e_1_3_4_13_1","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa2103695"},{"key":"e_1_3_4_14_1","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa2204619"},{"key":"e_1_3_4_15_1","doi-asserted-by":"publisher","DOI":"10.21037\/tlcr-2025-164"},{"key":"e_1_3_4_16_1","doi-asserted-by":"publisher","DOI":"10.1007\/s11523-024-01055-y"},{"key":"e_1_3_4_17_1","doi-asserted-by":"publisher","DOI":"10.1080\/14796694.2024.2407280"},{"key":"e_1_3_4_18_1","doi-asserted-by":"publisher","DOI":"10.3390\/ijms25063304"},{"key":"e_1_3_4_19_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-026-68319-1"},{"key":"e_1_3_4_20_1","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkae1091"},{"key":"e_1_3_4_21_1","volume-title":"Schr\u00f6dinger, LLC","author":"Schr\u00f6dinger","year":"2025","unstructured":"Schr\u00f6dinger. Schr\u00f6dinger, LLC. New York, NY: Schr\u00f6dinger, LLC, 2025."},{"key":"e_1_3_4_22_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.8b01026"},{"key":"e_1_3_4_23_1","volume-title":"Schr\u00f6dinger Release 2025-1: LigPrep","year":"2025","unstructured":"Schr\u00f6dinger Release 2025-1: LigPrep. New York, NY: Schr\u00f6dinger, LLC, 2025."},{"key":"e_1_3_4_24_1","doi-asserted-by":"publisher","DOI":"10.1021\/jm0306430"},{"key":"e_1_3_4_25_1","doi-asserted-by":"publisher","DOI":"10.1021\/jm051256o"},{"key":"e_1_3_4_26_1","volume-title":"Schr\u00f6dinger release 2025-1: prime","year":"2025","unstructured":"Schr\u00f6dinger release 2025-1: prime. New York, NY: Schr\u00f6dinger, LLC, 2025."},{"key":"e_1_3_4_27_1","unstructured":"Shaw DE. Schr\u00f6dinger Release 2025-1: Desmond molecular dynamics system; 2025."},{"key":"e_1_3_4_28_1","doi-asserted-by":"crossref","first-page":"43","DOI":"10.1109\/SC.2006.54","volume-title":"ACM\/IEEE SC 2006 Conference (SC\u201906). [Internet]","author":"Bowers KJ","year":"2006","unstructured":"Bowers KJ, Chow DE, Xu H, et al. Scalable algorithms for molecular dynamics simulations on commodity clusters. ACM\/IEEE SC 2006 Conference (SC\u201906). [Internet]. Tampa, FL: IEEE; 2006. [cited 2026 Mar 3]. p. 43\u201343. Available from: https:\/\/ieeexplore.ieee.org\/document\/4090217\/."},{"key":"e_1_3_4_29_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.compbiolchem.2020.107322"},{"issue":"1","key":"e_1_3_4_30_1","first-page":"82","article-title":"Pymol: an open-source molecular graphics tool","volume":"40","author":"DeLano WL.","year":"2002","unstructured":"DeLano WL. Pymol: an open-source molecular graphics tool. CCP4 Newsl Protein Crystallogr. 2002;40(1):82\u201392.","journal-title":"CCP4 Newsl Protein Crystallogr"},{"issue":"1","key":"e_1_3_4_31_1","first-page":"e1340","article-title":"PySCF: the Python\u2010based simulations of chemistry framework","volume":"8","author":"Sun Q","year":"2018","unstructured":"Sun Q, Berkelbach TC, Blunt NS, et al. PySCF: the Python\u2010based simulations of chemistry framework. Wiley Interdiscip Rev: Comput Mol Sci. 2018;8(1):e1340.","journal-title":"Wiley Interdiscip Rev: Comput Mol Sci"},{"key":"e_1_3_4_32_1","doi-asserted-by":"publisher","DOI":"10.3390\/molecules29061229"},{"key":"e_1_3_4_33_1","doi-asserted-by":"publisher","DOI":"10.3390\/ijms23031309"},{"key":"e_1_3_4_34_1","doi-asserted-by":"publisher","DOI":"10.1002\/slct.202300148"},{"key":"e_1_3_4_35_1","doi-asserted-by":"publisher","DOI":"10.2174\/0113816128395302251006180024"},{"key":"e_1_3_4_36_1","doi-asserted-by":"publisher","DOI":"10.3390\/ph17050551"},{"key":"e_1_3_4_37_1","doi-asserted-by":"publisher","DOI":"10.1080\/14756366.2025.2568121"},{"key":"e_1_3_4_38_1","doi-asserted-by":"publisher","DOI":"10.3390\/ijms232213845"},{"key":"e_1_3_4_39_1","doi-asserted-by":"publisher","DOI":"10.1007\/s11030-022-10534-1"}],"container-title":["Journal of Receptors and Signal Transduction"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/www.tandfonline.com\/doi\/pdf\/10.1080\/10799893.2026.2737641","content-type":"application\/pdf","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/www.tandfonline.com\/doi\/full-xml\/10.1080\/10799893.2026.2737641","content-type":"application\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/www.tandfonline.com\/doi\/pdf\/10.1080\/10799893.2026.2737641","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,9,26]],"date-time":"2026-09-26T12:24:51Z","timestamp":1790425491000},"score":1,"resource":{"primary":{"URL":"https:\/\/www.tandfonline.com\/doi\/full\/10.1080\/10799893.2026.2737641"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,9,26]]},"references-count":38,"alternative-id":["10.1080\/10799893.2026.2737641"],"URL":"https:\/\/doi.org\/10.1080\/10799893.2026.2737641","relation":{},"ISSN":["1079-9893","1532-4281"],"issn-type":[{"value":"1079-9893","type":"print"},{"value":"1532-4281","type":"electronic"}],"subject":[],"published":{"date-parts":[[2026,9,26]]},"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=irst20","URL":"http:\/\/www.tandfonline.com\/action\/journalInformation?show=aimsScope&journalCode=irst20","order":2,"name":"aims_and_scope_url","label":"Aim & Scope"},{"value":"2026-06-29","order":0,"name":"received","label":"Received","group":{"name":"publication_history","label":"Publication History"}},{"value":"2026-09-16","order":1,"name":"revised","label":"Revised","group":{"name":"publication_history","label":"Publication History"}},{"value":"2026-09-17","order":2,"name":"accepted","label":"Accepted","group":{"name":"publication_history","label":"Publication History"}},{"value":"2026-09-26","order":3,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}]}}