{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,23]],"date-time":"2026-07-23T13:02:33Z","timestamp":1784811753340,"version":"3.55.0"},"reference-count":51,"publisher":"American Chemical Society (ACS)","issue":"29","license":[{"start":{"date-parts":[[2027,7,9]],"date-time":"2027-07-09T00:00:00Z","timestamp":1815091200000},"content-version":"vor","delay-in-days":365,"URL":"https:\/\/creativecommons.org\/licenses\/by-nc-nd\/4.0\/"},{"start":{"date-parts":[[2026,7,9]],"date-time":"2026-07-09T00:00:00Z","timestamp":1783555200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2026,7,9]],"date-time":"2026-07-09T00:00:00Z","timestamp":1783555200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2026,7,9]],"date-time":"2026-07-09T00:00:00Z","timestamp":1783555200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/100000165","name":"Division of Chemistry","doi-asserted-by":"publisher","award":["2431276"],"award-info":[{"award-number":["2431276"]}],"id":[{"id":"10.13039\/100000165","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100005825","name":"National Institute of Food and Agriculture","doi-asserted-by":"publisher","award":["2025-38821-45453"],"award-info":[{"award-number":["2025-38821-45453"]}],"id":[{"id":"10.13039\/100005825","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000057","name":"National Institute of General Medical Sciences","doi-asserted-by":"publisher","award":["P20GM103446"],"award-info":[{"award-number":["P20GM103446"]}],"id":[{"id":"10.13039\/100000057","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000057","name":"National Institute of General Medical Sciences","doi-asserted-by":"publisher","award":["P20GM145765"],"award-info":[{"award-number":["P20GM145765"]}],"id":[{"id":"10.13039\/100000057","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000057","name":"National Institute of General Medical Sciences","doi-asserted-by":"publisher","award":["U54MD015959"],"award-info":[{"award-number":["U54MD015959"]}],"id":[{"id":"10.13039\/100000057","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Phys. Chem. B"],"published-print":{"date-parts":[[2026,7,23]]},"DOI":"10.1021\/acs.jpcb.6c00494","type":"journal-article","created":{"date-parts":[[2026,7,9]],"date-time":"2026-07-09T15:32:29Z","timestamp":1783611149000},"page":"7276-7290","source":"Crossref","is-referenced-by-count":0,"title":["Phenylalanine Transport through LAT1: Insights from Molecular Dynamics, Steered Molecular Dynamics, and Targeted Molecular Dynamics"],"prefix":"10.1021","volume":"130","author":[{"ORCID":"https:\/\/orcid.org\/0000-0001-5769-6844","authenticated-orcid":true,"given":"Shahidul M.","family":"Islam","sequence":"first","affiliation":[{"name":"Department of Chemistry","place":["Dover, United States"]},{"name":"Delaware State University","place":["Dover, United States"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0009-0000-9636-6688","authenticated-orcid":true,"given":"Md Mehedi","family":"Hasan","sequence":"additional","affiliation":[{"name":"Department of Chemistry","place":["Dover, United States"]},{"name":"Delaware State University","place":["Dover, United States"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Khushi","family":"Shah","sequence":"additional","affiliation":[{"name":"Department of Chemistry","place":["Dover, United States"]},{"name":"Delaware State University","place":["Dover, United States"]}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2026,7,9]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.3390\/ijms19051278"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.273.37.23629"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1038\/s41598-024-55252-w"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.8b01007"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.3389\/fchem.2018.00243"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.3390\/ijms24044042"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.3389\/FPSYT.2019.00561"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1186\/1471-2407-13-509"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1016\/j.ijrobp.2010.07.784"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1111\/j.1349-7006.2011.02151.x"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1002\/ijc.21866"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1111\/j.1440-1827.2008.02319.x"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1016\/j.lungcan.2009.05.020"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1016\/j.semcancer.2005.04.005"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1111\/j.1349-7006.2008.00969.x"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1227\/01.neu.0000316018.51292.19"},{"issue":"4","key":"ref17\/cit17","first-page":"1281","volume":"5","author":"Wang Q.","year":"2015","journal-title":"Am. J. Cancer Res."},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1093\/jnci\/djt241"},{"issue":"12","key":"ref19\/cit19","first-page":"4819","volume":"30","author":"Imai H.","year":"2010","journal-title":"Anticancer Res."},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1248\/bpb.31.1096"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.3892\/or_00000087"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1101\/gad.327056.119"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1016\/S0026-895X(24)12322-X"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1111\/j.1349-7006.2009.01386.x"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmcl.2016.04.023"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1016\/j.jphs.2017.01.006"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1038\/s41421-021-00247-4"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-019-1011-z"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-025-56903-w"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.3390\/ijms19051278"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1016\/j.biocel.2015.08.004"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.274.5.3009"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1038\/nsmb.2816"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1016\/j.bcp.2013.03.022"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.1c00203"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1016\/j.bpj.2009.04.013"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1021\/acsomega.1c05679"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.3c01069"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.1c01217"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20289"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1063\/5.0014475"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1063\/1.470648"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1063\/1.470117"},{"key":"ref44\/cit44","doi-asserted-by":"publisher","DOI":"10.1021\/ci4003574"},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0000880"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.23702"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1016\/0263-7855(96)00018-5"},{"key":"ref48\/cit48","unstructured":"BIOVIA, D. S.\n                      BIOVIA Discovery\nStudio\n                      ; Dassault Syst\u00e8mes: San Diego, 2024."},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21787"},{"key":"ref50\/cit50","doi-asserted-by":"publisher","unstructured":"Passaro, S.; Corso, G.; Wohlwend, J.; Reveiz, M.; Thaler, S.; Somnath, V. R.; Getz, N.; Portnoi, T.; Roy, J.; Stark, H.; Kwabi-Addo, D.; Beaini, D.; Jaakkola, T.; Barzilay, R. Boltz-2: Towards Accurate and Efficient Binding Affinity Prediction\n                      bioRxiv\n                      2025 10.1101\/2025.06.14.659707.","DOI":"10.1101\/2025.06.14.659707"},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1063\/1.5089636"}],"container-title":["The Journal of Physical Chemistry B"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jpcb.6c00494","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jpcb.6c00494","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,7,23]],"date-time":"2026-07-23T12:23:18Z","timestamp":1784809398000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jpcb.6c00494"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,7,9]]},"references-count":51,"journal-issue":{"issue":"29","published-print":{"date-parts":[[2026,7,23]]}},"alternative-id":["10.1021\/acs.jpcb.6c00494"],"URL":"https:\/\/doi.org\/10.1021\/acs.jpcb.6c00494","relation":{},"ISSN":["1520-6106","1520-5207"],"issn-type":[{"value":"1520-6106","type":"print"},{"value":"1520-5207","type":"electronic"}],"subject":[],"published":{"date-parts":[[2026,7,9]]}}}