{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,6,21]],"date-time":"2026-06-21T05:18:31Z","timestamp":1782019111711,"version":"3.54.5"},"reference-count":52,"publisher":"American Chemical Society (ACS)","issue":"2","license":[{"start":{"date-parts":[[2026,1,5]],"date-time":"2026-01-05T00:00:00Z","timestamp":1767571200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2026,1,5]],"date-time":"2026-01-05T00:00:00Z","timestamp":1767571200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2026,1,5]],"date-time":"2026-01-05T00:00:00Z","timestamp":1767571200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/100019180","name":"HORIZON EUROPE European Research Council","doi-asserted-by":"publisher","award":["101097272"],"award-info":[{"award-number":["101097272"]}],"id":[{"id":"10.13039\/100019180","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001665","name":"Agence Nationale de la Recherche","doi-asserted-by":"publisher","award":["ANR-22-PEBB-0009"],"award-info":[{"award-number":["ANR-22-PEBB-0009"]}],"id":[{"id":"10.13039\/501100001665","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100008990","name":"Universit? de Lorraine","doi-asserted-by":"publisher","id":[{"id":"10.13039\/100008990","id-type":"DOI","asserted-by":"publisher"}]},{"name":"R?gion Grand-Est"},{"name":"M?tropole du Grand Nancy"}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2026,1,26]]},"DOI":"10.1021\/acs.jcim.5c02906","type":"journal-article","created":{"date-parts":[[2026,1,5]],"date-time":"2026-01-05T16:49:56Z","timestamp":1767631796000},"page":"994-1002","source":"Crossref","is-referenced-by-count":1,"title":["From Static Pathways to Dynamic Mechanisms: A Committor-Based Data-Driven Approach to Chemical Reactions"],"prefix":"10.1021","volume":"66","author":[{"ORCID":"https:\/\/orcid.org\/0000-0001-6678-7801","authenticated-orcid":true,"given":"Radu A.","family":"Talmazan","sequence":"first","affiliation":[{"name":"Laboratoire International Associ\u00e9 Centre National de la Recherche Scientifique et University of Illinois at Urbana-Champaign","place":["Vand\u0153uvre-l\u00e8s-Nancy Cedex, France"]},{"name":"Unit\u00e9 Mixte de Recherche No. 7019, Universit\u00e9 de Lorraine","place":["Vand\u0153uvre-l\u00e8s-Nancy Cedex, France"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-9122-1698","authenticated-orcid":true,"given":"Christophe","family":"Chipot","sequence":"additional","affiliation":[{"name":"Laboratoire International Associ\u00e9 Centre National de la Recherche Scientifique et University of Illinois at Urbana-Champaign","place":["Vand\u0153uvre-l\u00e8s-Nancy Cedex, France"]},{"name":"Unit\u00e9 Mixte de Recherche No. 7019, Universit\u00e9 de Lorraine","place":["Vand\u0153uvre-l\u00e8s-Nancy Cedex, France"]},{"name":"Theoretical and Computational Biophysics Group, Beckman Institute, and Department of Physics","place":["Urbana, United States"]},{"name":"University of Illinois at Urbana-Champaign","place":["Urbana, United States"]},{"name":"Department of Biochemistry and Molecular Biology","place":["Chicago, United States"]},{"name":"The University of Chicago","place":["Chicago, United States"]}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2026,1,5]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1002\/anie.200800918"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1002\/poc.4202"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1021\/acs.accounts.1c00575"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1016\/j.checat.2025.101431"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.202427399"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1088\/0034-4885\/71\/12\/126601"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1016\/0021-9991(77)90121-8"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.66"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1002\/cphc.200400669"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpclett.8b01994"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1021\/acs.accounts.9b00473"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1063\/1.436049"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1038\/s43588-025-00828-3"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1021\/jacs.0c01975"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1021\/acs.chemrev.2c00896"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1021\/acscatal.4c00736"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1016\/j.jcat.2022.07.025"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1063\/1.464913"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.37.785"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21759"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1063\/1.438955"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.540040303"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1021\/jp9716997"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.1c00471"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevA.38.3098"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.33.8822"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.77.3865"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1063\/1.478522"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1063\/1.2148954"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.8b01176"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1039\/b508541a"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1063\/1.4939030"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1063\/1.4993215"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1063\/1.1329672"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1063\/1.1323224"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.100.020603"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1021\/acs.accounts.9b00473"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpclett.8b01994"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1063\/1.2432340"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.109.020601"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1063\/1.5027392"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1080\/00268976.2013.813594"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpcb.4c05604"},{"key":"ref44\/cit44","doi-asserted-by":"publisher","DOI":"10.1016\/0377-0427(87)90125-7"},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1080\/03610927408827101"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1109\/TPAMI.1979.4766909"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1063\/5.0004608"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20289"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.3c00798"},{"key":"ref50\/cit50","unstructured":"van Rossum, G.; Drake, F. L.\n                      Python 3 Reference Manual\n                      ; CreateSpace: Scotts Valley, CA, 2009."},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1016\/0263-7855(96)00018-5"},{"key":"ref52\/cit52","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpca.5b02127"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.5c02906","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.5c02906","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,1,26]],"date-time":"2026-01-26T09:11:20Z","timestamp":1769418680000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.5c02906"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,1,5]]},"references-count":52,"journal-issue":{"issue":"2","published-print":{"date-parts":[[2026,1,26]]}},"alternative-id":["10.1021\/acs.jcim.5c02906"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.5c02906","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2026,1,5]]}}}