{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,2,27]],"date-time":"2026-02-27T05:09:04Z","timestamp":1772168944132,"version":"3.50.1"},"reference-count":89,"publisher":"American Chemical Society (ACS)","issue":"2","license":[{"start":{"date-parts":[[2025,1,11]],"date-time":"2025-01-11T00:00:00Z","timestamp":1736553600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2025,1,11]],"date-time":"2025-01-11T00:00:00Z","timestamp":1736553600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2025,1,11]],"date-time":"2025-01-11T00:00:00Z","timestamp":1736553600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/100015866","name":"Hezkuntza, Hizkuntza Politika Eta Kultura Saila, Eusko Jaurlaritza","doi-asserted-by":"publisher","id":[{"id":"10.13039\/100015866","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2025,1,27]]},"DOI":"10.1021\/acs.jcim.4c02036","type":"journal-article","created":{"date-parts":[[2025,1,11]],"date-time":"2025-01-11T16:04:08Z","timestamp":1736611448000},"page":"785-797","source":"Crossref","is-referenced-by-count":5,"title":["Modeling and Elucidating the Behavior of a Thermoresponsive LCST Ionic Liquid"],"prefix":"10.1021","volume":"65","author":[{"ORCID":"https:\/\/orcid.org\/0000-0003-4253-9912","authenticated-orcid":true,"given":"Hussen O.","family":"Mohammed","sequence":"first","affiliation":[{"name":"Donostia International Physics Center (DIPC), 20018 Donostia-San Sebasti\u00e1n, Spain"},{"name":"Department of Organic Chemistry I, University of the Basque Country UPV\/EHU, 20018 Donostia-San Sebasti\u00e1n, Spain"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-8430-4076","authenticated-orcid":true,"given":"Abel","family":"de Cozar","sequence":"additional","affiliation":[{"name":"Donostia International Physics Center (DIPC), 20018 Donostia-San Sebasti\u00e1n, Spain"},{"name":"Department of Organic Chemistry I, University of the Basque Country UPV\/EHU, 20018 Donostia-San Sebasti\u00e1n, Spain"},{"name":"IKERBASQUE, Basque Foundation for Science, 48009 Bilbao, Spain"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-5332-885X","authenticated-orcid":true,"given":"Ronen","family":"Zangi","sequence":"additional","affiliation":[{"name":"Donostia International Physics Center (DIPC), 20018 Donostia-San Sebasti\u00e1n, Spain"},{"name":"Department of Organic Chemistry I, University of the Basque Country UPV\/EHU, 20018 Donostia-San Sebasti\u00e1n, Spain"},{"name":"IKERBASQUE, Basque Foundation for Science, 48009 Bilbao, Spain"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2025,1,11]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.3390\/app11020670"},{"key":"ref2\/cit2","doi-asserted-by":"crossref","DOI":"10.1002\/9781118347737","volume-title":"Advances in Water Desalination","author":"Lior N.","year":"2012"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1016\/j.desal.2016.06.020"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1080\/19443994.2012.699509"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1016\/j.desal.2017.07.012"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1016\/j.watres.2019.115402"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1088\/1757-899X\/1146\/1\/012029"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1016\/j.memsci.2011.12.023"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1016\/j.desal.2016.03.021"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.3390\/pr8040404"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1002\/cjoc.202000414"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1021\/acs.est.0c06232"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1039\/c3ta12559a"},{"key":"ref14\/cit14","doi-asserted-by":"crossref","unstructured":"Chen, S.; Lu, X. Smart Materials for Advanced Environmental Applications; The Royal Society of Chemistry, 2016; pp 19\u201350.","DOI":"10.1039\/9781782622192-00019"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1016\/j.desal.2022.116067"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.3390\/molecules28196817"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1016\/j.seppur.2020.117286"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1088\/1757-899X\/736\/4\/042027"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1039\/C4EW00073K"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1021\/acs.est.5b03747"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1021\/acsomega.8b02827"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1016\/j.colsurfa.2022.128372"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1016\/j.memsci.2018.10.004"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1021\/acsomega.2c05279"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1016\/j.desal.2007.02.014"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1016\/j.desal.2022.116359"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1039\/c3ta14256f"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1039\/C8CP02408A"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpcb.3c01655"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1039\/C6CC02838A"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1038\/s42004-019-0151-2"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.3390\/molecules27051647"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1039\/C6CP03439J"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1021\/acs.iecr.8b02073"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1021\/acsmacrolett.5b00355"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpcb.0c07575"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1071\/CH11278"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1039\/C4PY01665C"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1016\/j.desal.2020.114635"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1016\/j.seppur.2021.119164"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.3390\/membranes12111067"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1021\/jp068365e"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1021\/j100142a004"},{"key":"ref44\/cit44","unstructured":"Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Petersson, G. A.; Nakatsuji, H.; Li, X.; Caricato, M.; Marenich, A. V.; Bloino, J.; Janesko, B. G.; Gomperts, R.; Mennucci, B.; Hratchian, H. P.; Ortiz, J. V.; Izmaylov, A. F.; Sonnenberg, J. L.; Williams-Young, D.; Ding, F.; Lipparini, F.; Egidi, F.; Goings, J.; Peng, B.; Petrone, A.; Henderson, T.; Ranasinghe, D.; Zakrzewski, V. G.; Gao, J.; Rega, N.; Zheng, G.; Liang, W.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Vreven, T.; Throssell, K.; Montgomery, J. A., Jr.; Peralta, J. E.; Ogliaro, F.; Bearpark, M. J.; Heyd, J. J.; Brothers, E. N.; Kudin, K. N.; Staroverov, V. N.; Keith, T. A.; Kobayashi, R.; Normand, J.; Raghavachari, K.; Rendell, A. P.; Burant, J. C.; Iyengar, S. S.; Tomasi, J.; Cossi, M.; Millam, J. M.; Klene, M.; Adamo, C.; Cammi, R.; Ochterski, J. W.; Martin, R. L.; Morokuma, K.; Farkas, O.; Foresman, J. B.; Fox, D. J. Gaussian 16, Revision 01.C; Gaussian Inc.: Wallingford, CT, 2016."},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1021\/ja00124a002"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1002\/(SICI)1096-987X(199709)18:12<1463::AID-JCC4>3.0.CO;2-H"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1063\/1.2121687"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1016\/j.softx.2015.06.001"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1063\/1.2408420"},{"key":"ref50\/cit50","doi-asserted-by":"publisher","DOI":"10.1063\/1.328693"},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21224"},{"key":"ref52\/cit52","doi-asserted-by":"publisher","DOI":"10.1063\/1.447334"},{"key":"ref53\/cit53","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevA.31.1695"},{"key":"ref54\/cit54","doi-asserted-by":"publisher","DOI":"10.1063\/1.463940"},{"key":"ref55\/cit55","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.76.928"},{"key":"ref56\/cit56","doi-asserted-by":"publisher","DOI":"10.1021\/jp909219k"},{"key":"ref57\/cit57","unstructured":"Bernstein, H. J. Rasmol 2.7.5.1. http:\/\/www.rasmol.org\/."},{"key":"ref58\/cit58","unstructured":"Mitchell, M.; Jedrzejewski-Szmek, Z.; Muftakhidinov, B.; Winchen, T. Engauge Digitizer, version 7. https:\/\/markummitchell.github.io\/engauge-digitizer\/ (accessed March 5, 2016)."},{"key":"ref59\/cit59","doi-asserted-by":"publisher","DOI":"10.1021\/jp910771q"},{"key":"ref60\/cit60","doi-asserted-by":"publisher","DOI":"10.1039\/c1cp21379b"},{"key":"ref61\/cit61","doi-asserted-by":"publisher","DOI":"10.1039\/C1FD00051A"},{"key":"ref62\/cit62","doi-asserted-by":"publisher","DOI":"10.1021\/ct500271z"},{"key":"ref63\/cit63","doi-asserted-by":"publisher","DOI":"10.1002\/anie.201308760"},{"key":"ref64\/cit64","doi-asserted-by":"publisher","DOI":"10.1016\/j.molliq.2014.12.045"},{"key":"ref65\/cit65","doi-asserted-by":"publisher","DOI":"10.1039\/C4CP01177E"},{"key":"ref66\/cit66","doi-asserted-by":"publisher","DOI":"10.1039\/C9CP05478B"},{"key":"ref67\/cit67","doi-asserted-by":"publisher","DOI":"10.1002\/cphc.200800200"},{"key":"ref68\/cit68","doi-asserted-by":"publisher","DOI":"10.1021\/acs.chemrev.8b00763"},{"key":"ref69\/cit69","doi-asserted-by":"publisher","DOI":"10.1063\/1.2772268"},{"key":"ref70\/cit70","doi-asserted-by":"publisher","DOI":"10.1021\/jp204148q"},{"key":"ref71\/cit71","doi-asserted-by":"publisher","DOI":"10.1039\/c0cp02778b"},{"key":"ref72\/cit72","doi-asserted-by":"publisher","DOI":"10.1021\/jp109612k"},{"key":"ref73\/cit73","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.7b00520"},{"key":"ref74\/cit74","doi-asserted-by":"publisher","DOI":"10.1039\/C8CP01700J"},{"key":"ref75\/cit75","doi-asserted-by":"publisher","DOI":"10.1063\/5.0017775"},{"key":"ref76\/cit76","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpcb.0c02641"},{"key":"ref77\/cit77","doi-asserted-by":"publisher","DOI":"10.1016\/j.jil.2022.100020"},{"key":"ref78\/cit78","doi-asserted-by":"publisher","DOI":"10.1002\/cphc.200700552"},{"key":"ref79\/cit79","doi-asserted-by":"publisher","DOI":"10.1021\/jp067142l"},{"key":"ref80\/cit80","doi-asserted-by":"publisher","DOI":"10.1071\/CH12282"},{"key":"ref81\/cit81","doi-asserted-by":"publisher","DOI":"10.1021\/jp1090284"},{"key":"ref82\/cit82","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpcb.1c01850"},{"key":"ref83\/cit83","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.100.115901"},{"key":"ref84\/cit84","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpcb.7b06453"},{"key":"ref85\/cit85","doi-asserted-by":"publisher","DOI":"10.1063\/1.4705692"},{"key":"ref86\/cit86","doi-asserted-by":"publisher","DOI":"10.1021\/acs.chemrev.5b00742"},{"key":"ref87\/cit87","doi-asserted-by":"publisher","DOI":"10.1021\/jp909034c"},{"key":"ref88\/cit88","doi-asserted-by":"publisher","DOI":"10.1063\/1.1723985"},{"key":"ref89\/cit89","doi-asserted-by":"publisher","DOI":"10.1016\/j.bbagen.2020.129537"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.4c02036","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.4c02036","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2025,1,27]],"date-time":"2025-01-27T09:15:11Z","timestamp":1737969311000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.4c02036"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2025,1,11]]},"references-count":89,"journal-issue":{"issue":"2","published-print":{"date-parts":[[2025,1,27]]}},"alternative-id":["10.1021\/acs.jcim.4c02036"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.4c02036","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2025,1,11]]}}}