{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,2]],"date-time":"2026-07-02T05:26:29Z","timestamp":1782969989021,"version":"3.54.5"},"reference-count":100,"publisher":"Royal Society of Chemistry (RSC)","issue":"9","license":[{"start":{"date-parts":[[2025,8,13]],"date-time":"2025-08-13T00:00:00Z","timestamp":1755043200000},"content-version":"vor","delay-in-days":224,"URL":"http:\/\/creativecommons.org\/licenses\/by-nc\/3.0\/"}],"funder":[{"DOI":"10.13039\/100000071","name":"National Institute of Child Health and Human Development","doi-asserted-by":"publisher","award":["UHD113039"],"award-info":[{"award-number":["UHD113039"]}],"id":[{"id":"10.13039\/100000071","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000066","name":"National Institute of Environmental Health Sciences","doi-asserted-by":"publisher","award":["R01ES031080"],"award-info":[{"award-number":["R01ES031080"]}],"id":[{"id":"10.13039\/100000066","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000001","name":"National Science Foundation","doi-asserted-by":"publisher","award":["2108699"],"award-info":[{"award-number":["2108699"]}],"id":[{"id":"10.13039\/100000001","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000001","name":"National Science Foundation","doi-asserted-by":"publisher","award":["2402311"],"award-info":[{"award-number":["2402311"]}],"id":[{"id":"10.13039\/100000001","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["rsc.org"],"crossmark-restriction":true},"short-container-title":["Digital Discovery"],"abstract":"<jats:p>High throughput screening and machine learning can be used to develop novel synthetic chloride transporters with potential therapeutic applications, as well as elucidate the molecular features needed to achieve transmembrane chloride transport.<\/jats:p>","DOI":"10.1039\/d5dd00140d","type":"journal-article","created":{"date-parts":[[2025,8,13]],"date-time":"2025-08-13T14:21:11Z","timestamp":1755094871000},"page":"2615-2626","update-policy":"https:\/\/doi.org\/10.1039\/rsc_crossmark_policy","source":"Crossref","is-referenced-by-count":1,"title":["Development of synthetic chloride transporters using high-throughput screening and machine learning"],"prefix":"10.1039","volume":"4","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-0131-7830","authenticated-orcid":false,"given":"Surid Mohammad","family":"Chowdhury","sequence":"first","affiliation":[{"name":"Department of Chemistry, Tulane University, New Orleans, Louisiana 70118, USA"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0009-0008-2396-3930","authenticated-orcid":false,"given":"Nada J.","family":"Daood","sequence":"additional","affiliation":[{"name":"Center for Biomedical Informatics and Genomics, Tulane University, New Orleans, Louisiana 70112, USA"},{"name":"Department of Chemistry and Biochemistry, Rowan University, Glassboro, New Jersey 08028, USA"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Katherine R.","family":"Lewis","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Tulane University, New Orleans, Louisiana 70118, USA"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-3007-6108","authenticated-orcid":false,"given":"Rayhanus","family":"Salam","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Tulane University, New Orleans, Louisiana 70118, USA"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-3559-6129","authenticated-orcid":false,"given":"Hao","family":"Zhu","sequence":"additional","affiliation":[{"name":"Center for Biomedical Informatics and Genomics, Tulane University, New Orleans, Louisiana 70112, USA"},{"name":"Department of Chemistry and Biochemistry, Rowan University, Glassboro, New Jersey 08028, USA"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-3612-3382","authenticated-orcid":false,"given":"Nathalie","family":"Busschaert","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Tulane University, New Orleans, Louisiana 70118, USA"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"292","published-online":{"date-parts":[[2025]]},"reference":[{"key":"D5DD00140D\/cit1\/1","doi-asserted-by":"crossref","first-page":"5896","DOI":"10.1073\/pnas.0730857100","volume":"100","author":"Maya","year":"2003","journal-title":"Proc. Natl. Acad. Sci. U. S. A."},{"key":"D5DD00140D\/cit2\/1","doi-asserted-by":"crossref","first-page":"1","DOI":"10.3345\/kjp.2014.57.1.1","volume":"57","author":"Kim","year":"2014","journal-title":"Korean J. Pediatr."},{"key":"D5DD00140D\/cit3\/1","doi-asserted-by":"crossref","first-page":"465","DOI":"10.1007\/s00424-003-1192-y","volume":"447","author":"Hediger","year":"2004","journal-title":"Pflueg. Arch. Eur. J. Physiol."},{"key":"D5DD00140D\/cit4\/1","doi-asserted-by":"crossref","first-page":"95","DOI":"10.1016\/j.mam.2012.12.009","volume":"34","author":"Hediger","year":"2013","journal-title":"Mol. Aspects Med."},{"key":"D5DD00140D\/cit5\/1","doi-asserted-by":"crossref","first-page":"202","DOI":"10.1126\/science.1712984","volume":"253","author":"Anderson","year":"1991","journal-title":"Science"},{"key":"D5DD00140D\/cit6\/1","first-page":"L694","volume":"277","author":"Ballard","year":"1999","journal-title":"Am. J. Physiol.: Lung Cell. Mol. Physiol."},{"key":"D5DD00140D\/cit7\/1","doi-asserted-by":"crossref","first-page":"349","DOI":"10.1038\/nrd3723","volume":"11","author":"Davis","year":"2012","journal-title":"Nat. Rev. Drug Discovery"},{"key":"D5DD00140D\/cit8\/1","doi-asserted-by":"crossref","first-page":"220","DOI":"10.1056\/NEJMoa1409547","volume":"373","author":"Wainwright","year":"2015","journal-title":"N. Engl. J. Med."},{"key":"D5DD00140D\/cit9\/1","doi-asserted-by":"crossref","first-page":"725","DOI":"10.1080\/17476348.2018.1507741","volume":"12","author":"Sala","year":"2018","journal-title":"Expet Rev. Respir. Med."},{"key":"D5DD00140D\/cit10\/1","doi-asserted-by":"crossref","first-page":"65","DOI":"10.1016\/S2213-2600(19)30337-6","volume":"8","author":"Bell","year":"2020","journal-title":"Lancet Respir. Med."},{"key":"D5DD00140D\/cit11\/1","doi-asserted-by":"publisher","first-page":"547","DOI":"10.1007\/978-3-030-55454-5_15","volume-title":"Studies of Epithelial Transporters and Ion Channels: Ion Channels and Transporters of Epithelia in Health and Disease","volume":"3","author":"Bradbury","year":"2020","unstructured":"N. A.Bradbury , in  Studies of Epithelial Transporters and Ion Channels: Ion Channels and Transporters of Epithelia in Health and Disease , ed.  K. L. Hamilton  and  D. C. Devor ,  Springer International Publishing ,  Cham ,  2020 ,  vol. 3 ,  pp. 547\u2013604 ,  10.1007\/978-3-030-55454-5_15"},{"key":"D5DD00140D\/cit12\/1","doi-asserted-by":"crossref","first-page":"543","DOI":"10.1038\/nrd4626","volume":"14","author":"Lin","year":"2015","journal-title":"Nat. Rev. Drug Discovery"},{"key":"D5DD00140D\/cit13\/1","doi-asserted-by":"crossref","first-page":"667","DOI":"10.1038\/nchem.2706","volume":"9","author":"Busschaert","year":"2017","journal-title":"Nat. Chem."},{"key":"D5DD00140D\/cit14\/1","doi-asserted-by":"crossref","first-page":"3838","DOI":"10.1039\/D1OB00263E","volume":"19","author":"Herschede","year":"2021","journal-title":"Org. Biomol. Chem."},{"key":"D5DD00140D\/cit15\/1","doi-asserted-by":"crossref","first-page":"2497","DOI":"10.1039\/C7CS00159B","volume":"46","author":"Gale","year":"2017","journal-title":"Chem. Soc. Rev."},{"key":"D5DD00140D\/cit16\/1","doi-asserted-by":"crossref","first-page":"6056","DOI":"10.1039\/C9CS00662A","volume":"49","author":"Davis","year":"2020","journal-title":"Chem. Soc. Rev."},{"key":"D5DD00140D\/cit17\/1","doi-asserted-by":"crossref","first-page":"885","DOI":"10.3390\/biomedicines10040885","volume":"10","author":"Picci","year":"2022","journal-title":"Biomedicines"},{"key":"D5DD00140D\/cit18\/1","doi-asserted-by":"crossref","first-page":"203","DOI":"10.1016\/j.ejim.2011.11.013","volume":"23","author":"Berend","year":"2012","journal-title":"Eur. J. Intern. Med."},{"key":"D5DD00140D\/cit19\/1","doi-asserted-by":"crossref","first-page":"1128","DOI":"10.1039\/c3sc52962b","volume":"5","author":"Valkenier","year":"2014","journal-title":"Chem. Sci."},{"key":"D5DD00140D\/cit20\/1","doi-asserted-by":"crossref","first-page":"3036","DOI":"10.1039\/c3sc51023a","volume":"4","author":"Busschaert","year":"2013","journal-title":"Chem. Sci."},{"key":"D5DD00140D\/cit21\/1","doi-asserted-by":"crossref","first-page":"1600","DOI":"10.1039\/C5SC03932K","volume":"7","author":"Knight","year":"2016","journal-title":"Chem. Sci."},{"key":"D5DD00140D\/cit22\/1","doi-asserted-by":"crossref","first-page":"1338","DOI":"10.1021\/ja806476t","volume":"131","author":"Mehiri","year":"2009","journal-title":"J. Am. Chem. Soc."},{"key":"D5DD00140D\/cit23\/1","doi-asserted-by":"crossref","first-page":"5274","DOI":"10.1039\/c2cc31825c","volume":"48","author":"Saggiomo","year":"2012","journal-title":"Chem. Commun."},{"key":"D5DD00140D\/cit24\/1","doi-asserted-by":"crossref","first-page":"4592","DOI":"10.1002\/anie.201411805","volume":"54","author":"Edwards","year":"2015","journal-title":"Angew. Chem., Int. Ed."},{"key":"D5DD00140D\/cit25\/1","first-page":"e202300044","volume":"4","author":"Chvojka","year":"2024","journal-title":"Anal. Sens."},{"key":"D5DD00140D\/cit26\/1","first-page":"e202400084","author":"Yang","year":"2025","journal-title":"Chem.: Methods"},{"key":"D5DD00140D\/cit27\/1","doi-asserted-by":"crossref","first-page":"4426","DOI":"10.1002\/anie.201200729","volume":"51","author":"Busschaert","year":"2012","journal-title":"Angew. Chem., Int. Ed."},{"key":"D5DD00140D\/cit28\/1","doi-asserted-by":"crossref","first-page":"14455","DOI":"10.1039\/D0CC06437H","volume":"56","author":"Marshall","year":"2020","journal-title":"Chem. Commun."},{"key":"D5DD00140D\/cit29\/1","doi-asserted-by":"crossref","first-page":"21455","DOI":"10.1074\/jbc.273.34.21455","volume":"273","author":"Sato","year":"1998","journal-title":"J. Biol. Chem."},{"key":"D5DD00140D\/cit30\/1","doi-asserted-by":"crossref","first-page":"731","DOI":"10.1042\/bj3340731","volume":"334","author":"Ohkuma","year":"1998","journal-title":"Biochem. J."},{"key":"D5DD00140D\/cit31\/1","doi-asserted-by":"publisher","first-page":"5781","DOI":"10.1039\/B511847F","author":"Seganish","year":"2005","journal-title":"Chem. Commun."},{"key":"D5DD00140D\/cit32\/1","doi-asserted-by":"crossref","first-page":"145","DOI":"10.1007\/7081_2010_29","volume-title":"Anion Recognition in Supramolecular Chemistry","author":"Davis","year":"2010","unstructured":"J. T.Davis ,  Anion Recognition in Supramolecular Chemistry ,  2010 ,  pp. 145\u2013176"},{"key":"D5DD00140D\/cit33\/1","doi-asserted-by":"crossref","first-page":"3834","DOI":"10.1039\/c3ob40477c","volume":"11","author":"Rastogi","year":"2013","journal-title":"Org. Biomol. Chem."},{"key":"D5DD00140D\/cit34\/1","doi-asserted-by":"crossref","first-page":"7515","DOI":"10.1039\/C4OB01399A","volume":"12","author":"Marchal","year":"2014","journal-title":"Org. Biomol. Chem."},{"key":"D5DD00140D\/cit35\/1","doi-asserted-by":"crossref","first-page":"297","DOI":"10.1080\/10610278.2019.1574017","volume":"31","author":"Jowett","year":"2019","journal-title":"Supramol. Chem."},{"key":"D5DD00140D\/cit36\/1","doi-asserted-by":"crossref","first-page":"156","DOI":"10.1016\/j.colsurfb.2009.05.014","volume":"73","author":"Shimanouchi","year":"2009","journal-title":"Colloids Surf., B"},{"key":"D5DD00140D\/cit37\/1","doi-asserted-by":"crossref","first-page":"127","DOI":"10.1016\/j.chempr.2016.04.002","volume":"1","author":"Wu","year":"2016","journal-title":"Chem"},{"key":"D5DD00140D\/cit38\/1","doi-asserted-by":"crossref","first-page":"14136","DOI":"10.1021\/ja205884y","volume":"133","author":"Busschaert","year":"2011","journal-title":"J. Am. Chem. Soc."},{"key":"D5DD00140D\/cit39\/1","doi-asserted-by":"crossref","first-page":"2501","DOI":"10.1039\/c2sc20551c","volume":"3","author":"Moore","year":"2012","journal-title":"Chem. Sci."},{"key":"D5DD00140D\/cit40\/1","doi-asserted-by":"crossref","first-page":"888","DOI":"10.1002\/chem.201904255","volume":"26","author":"Vieira","year":"2020","journal-title":"Chem.\u2013Eur. J."},{"key":"D5DD00140D\/cit41\/1","doi-asserted-by":"crossref","first-page":"935","DOI":"10.1021\/acsabm.9b00985","volume":"3","author":"Biswas","year":"2020","journal-title":"ACS Appl. Bio Mater."},{"key":"D5DD00140D\/cit42\/1","doi-asserted-by":"crossref","first-page":"25521","DOI":"10.1021\/acsami.0c01259","volume":"12","author":"Akhtar","year":"2020","journal-title":"ACS Appl. Mater. Interfaces"},{"key":"D5DD00140D\/cit43\/1","doi-asserted-by":"crossref","first-page":"3633","DOI":"10.1039\/b926225n","volume":"39","author":"Brotherhood","year":"2010","journal-title":"Chem. Soc. Rev."},{"key":"D5DD00140D\/cit44\/1","doi-asserted-by":"crossref","first-page":"9599","DOI":"10.1002\/chem.200801163","volume":"14","author":"McNally","year":"2008","journal-title":"Chem.\u2013Eur. J."},{"key":"D5DD00140D\/cit45\/1","doi-asserted-by":"crossref","first-page":"6252","DOI":"10.1039\/c0cc01684e","volume":"46","author":"Busschaert","year":"2010","journal-title":"Chem. Commun."},{"key":"D5DD00140D\/cit46\/1","doi-asserted-by":"crossref","first-page":"256","DOI":"10.1039\/C0SC00503G","volume":"2","author":"Andrews","year":"2011","journal-title":"Chem. Sci."},{"key":"D5DD00140D\/cit47\/1","doi-asserted-by":"crossref","first-page":"14235","DOI":"10.1039\/C5CC05737J","volume":"51","author":"Valkenier","year":"2015","journal-title":"Chem. Commun."},{"key":"D5DD00140D\/cit48\/1","doi-asserted-by":"crossref","first-page":"1083","DOI":"10.1039\/C7OB02787G","volume":"16","author":"Dias","year":"2018","journal-title":"Org. Biomol. Chem."},{"key":"D5DD00140D\/cit49\/1","doi-asserted-by":"crossref","first-page":"12507","DOI":"10.1021\/ja507551z","volume":"136","author":"Valkenier","year":"2014","journal-title":"J. Am. Chem. Soc."},{"key":"D5DD00140D\/cit50\/1","doi-asserted-by":"crossref","first-page":"e202301412","DOI":"10.1002\/chem.202301412","volume":"29","author":"Roy","year":"2023","journal-title":"Chem.\u2013Eur. J."},{"key":"D5DD00140D\/cit51\/1","doi-asserted-by":"crossref","first-page":"4238","DOI":"10.1002\/anie.201700803","volume":"56","author":"Shinde","year":"2017","journal-title":"Angew. Chem., Int. Ed."},{"key":"D5DD00140D\/cit52\/1","doi-asserted-by":"crossref","first-page":"1241","DOI":"10.1002\/chem.201605033","volume":"23","author":"Roy","year":"2017","journal-title":"Chem.\u2013Eur. J."},{"key":"D5DD00140D\/cit53\/1","doi-asserted-by":"crossref","first-page":"371","DOI":"10.1021\/acsinfecdis.3c00455","volume":"10","author":"Mondal","year":"2024","journal-title":"ACS Infect. Dis."},{"key":"D5DD00140D\/cit54\/1","doi-asserted-by":"crossref","first-page":"1087","DOI":"10.1039\/b414589e","author":"McNally","year":"2005","journal-title":"Chem. Commun."},{"key":"D5DD00140D\/cit55\/1","doi-asserted-by":"crossref","first-page":"24","DOI":"10.1038\/nchem.2384","volume":"8","author":"Li","year":"2016","journal-title":"Nat. Chem."},{"key":"D5DD00140D\/cit56\/1","doi-asserted-by":"crossref","first-page":"1764","DOI":"10.1111\/bph.14649","volume":"176","author":"Fiore","year":"2019","journal-title":"Br. J. Pharmacol."},{"key":"D5DD00140D\/cit57\/1","doi-asserted-by":"crossref","first-page":"9397","DOI":"10.1038\/s41598-017-09645-9","volume":"7","author":"Jowett","year":"2017","journal-title":"Sci. Rep."},{"key":"D5DD00140D\/cit58\/1","doi-asserted-by":"crossref","first-page":"7828","DOI":"10.1021\/acs.orglett.9b02823","volume":"21","author":"Aslam","year":"2019","journal-title":"Org. Lett."},{"key":"D5DD00140D\/cit59\/1","doi-asserted-by":"crossref","first-page":"5633","DOI":"10.1039\/C9OB00725C","volume":"17","author":"Motloch","year":"2019","journal-title":"Org. Biomol. Chem."},{"key":"D5DD00140D\/cit60\/1","doi-asserted-by":"crossref","first-page":"1558","DOI":"10.1039\/C8OB03036G","volume":"17","author":"Yu","year":"2019","journal-title":"Org. Biomol. Chem."},{"key":"D5DD00140D\/cit61\/1","doi-asserted-by":"crossref","first-page":"5779","DOI":"10.1039\/C9OB00650H","volume":"17","author":"Saha","year":"2019","journal-title":"Org. Biomol. Chem."},{"key":"D5DD00140D\/cit62\/1","doi-asserted-by":"crossref","first-page":"33803","DOI":"10.1021\/acsami.8b06664","volume":"10","author":"Akhtar","year":"2018","journal-title":"ACS Appl. Mater. Interfaces"},{"key":"D5DD00140D\/cit63\/1","doi-asserted-by":"crossref","first-page":"7558","DOI":"10.1021\/jacs.6b01723","volume":"138","author":"Saha","year":"2016","journal-title":"J. Am. Chem. Soc."},{"key":"D5DD00140D\/cit64\/1","doi-asserted-by":"crossref","first-page":"16395","DOI":"10.1021\/acsomega.0c00438","volume":"5","author":"Kulsi","year":"2020","journal-title":"ACS Omega"},{"key":"D5DD00140D\/cit65\/1","doi-asserted-by":"crossref","first-page":"5354","DOI":"10.1002\/anie.201900869","volume":"58","author":"Salunke","year":"2019","journal-title":"Angew. Chem., Int. Ed."},{"key":"D5DD00140D\/cit66\/1","doi-asserted-by":"crossref","first-page":"7560","DOI":"10.1039\/C6CC03645G","volume":"52","author":"Share","year":"2016","journal-title":"Chem. Commun."},{"key":"D5DD00140D\/cit67\/1","doi-asserted-by":"crossref","first-page":"2420","DOI":"10.1039\/C9SC06520B","volume":"11","author":"Malla","year":"2020","journal-title":"Chem. Sci."},{"key":"D5DD00140D\/cit68\/1","doi-asserted-by":"crossref","first-page":"2024","DOI":"10.1039\/C7CC08693H","volume":"54","author":"Roy","year":"2018","journal-title":"Chem. Commun."},{"key":"D5DD00140D\/cit69\/1","doi-asserted-by":"crossref","first-page":"8690","DOI":"10.1039\/C8OB01345D","volume":"16","author":"Mondal","year":"2018","journal-title":"Org. Biomol. Chem."},{"key":"D5DD00140D\/cit70\/1","doi-asserted-by":"crossref","first-page":"4483","DOI":"10.1039\/C9OB00554D","volume":"17","author":"Shinde","year":"2019","journal-title":"Org. Biomol. Chem."},{"key":"D5DD00140D\/cit71\/1","doi-asserted-by":"crossref","first-page":"129193","DOI":"10.1016\/j.jhazmat.2022.129193","volume":"436","author":"Jia","year":"2022","journal-title":"J. Hazard. Mater."},{"key":"D5DD00140D\/cit72\/1","doi-asserted-by":"crossref","first-page":"5984","DOI":"10.1021\/acs.est.2c01040","volume":"56","author":"Ciallella","year":"2022","journal-title":"Environ. Sci. Technol."},{"key":"D5DD00140D\/cit73\/1","doi-asserted-by":"crossref","first-page":"6573","DOI":"10.1021\/acs.est.3c00648","volume":"57","author":"Chung","year":"2023","journal-title":"Environ. Sci. Technol."},{"key":"D5DD00140D\/cit74\/1","doi-asserted-by":"crossref","first-page":"705","DOI":"10.1021\/ci400737s","volume":"54","author":"Zakharov","year":"2014","journal-title":"J. Chem. Inf. Model."},{"key":"D5DD00140D\/cit75\/1","doi-asserted-by":"crossref","first-page":"3213","DOI":"10.1021\/acs.jcim.0c01439","volume":"61","author":"Casanova-Alvarez","year":"2021","journal-title":"J. Chem. Inf. Model."},{"key":"D5DD00140D\/cit76\/1","doi-asserted-by":"crossref","first-page":"321","DOI":"10.1613\/jair.953","volume":"16","author":"Chawla","year":"2002","journal-title":"J. Artif. Intell. Res."},{"key":"D5DD00140D\/cit77\/1","doi-asserted-by":"crossref","first-page":"100690","DOI":"10.1016\/j.imu.2021.100690","volume":"25","author":"Mienye","year":"2021","journal-title":"Inform. Med. Unlocked"},{"key":"D5DD00140D\/cit78\/1","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1021\/ci400572x","volume":"54","author":"Golbraikh","year":"2014","journal-title":"J. Chem. Inf. Model."},{"key":"D5DD00140D\/cit79\/1","doi-asserted-by":"crossref","first-page":"490","DOI":"10.1038\/s41374-020-00477-2","volume":"101","author":"Ciallella","year":"2021","journal-title":"Lab. Invest."},{"key":"D5DD00140D\/cit80\/1","doi-asserted-by":"crossref","first-page":"474","DOI":"10.1021\/envhealth.4c00026","volume":"2","author":"Daood","year":"2024","journal-title":"Environ. Health"},{"key":"D5DD00140D\/cit81\/1","doi-asserted-by":"crossref","first-page":"464","DOI":"10.1016\/S1093-3263(00)00068-1","volume":"18","author":"Labute","year":"2000","journal-title":"J. Mol. Graphics Modell."},{"key":"D5DD00140D\/cit82\/1","doi-asserted-by":"publisher","first-page":"367","DOI":"10.1002\/9780470125793.ch9","volume-title":"Rev. Comput. Chem.","author":"Hall","year":"1991","unstructured":"L. H.Hall  and  L. B.Kier , in  Rev. Comput. Chem. ,  1991 ,  pp. 367\u2013422 ,  10.1002\/9780470125793.ch9"},{"key":"D5DD00140D\/cit83\/1","doi-asserted-by":"crossref","first-page":"801","DOI":"10.1023\/A:1015952613760","volume":"7","author":"Kier","year":"1990","journal-title":"Pharm. Res."},{"key":"D5DD00140D\/cit84\/1","doi-asserted-by":"crossref","first-page":"D1265","DOI":"10.1093\/nar\/gkad976","volume":"52","author":"Knox","year":"2023","journal-title":"Nucleic Acids Res."},{"key":"D5DD00140D\/cit85\/1","unstructured":"Even if brilliant green is not considered as an active compound, 4\/10 active compounds (40%) still represents a 10x higher hit rate compared to a random screen"},{"key":"D5DD00140D\/cit86\/1","doi-asserted-by":"crossref","first-page":"148","DOI":"10.1002\/cmdc.200900314","volume":"5","author":"Kr\u00fcger","year":"2010","journal-title":"ChemMedChem"},{"key":"D5DD00140D\/cit87\/1","unstructured":"The current model is built using drug-like molecules and can therefore only be used to predict the activity of hydrogen-bonding-based chloride transporters"},{"key":"D5DD00140D\/cit88\/1","doi-asserted-by":"crossref","first-page":"734","DOI":"10.1021\/ja00211a012","volume":"110","author":"Riddell","year":"1988","journal-title":"J. Am. Chem. Soc."},{"key":"D5DD00140D\/cit89\/1","doi-asserted-by":"crossref","first-page":"111262","DOI":"10.1016\/j.biopha.2021.111262","volume":"137","author":"Gao","year":"2021","journal-title":"Biomed. Pharmacother."},{"key":"D5DD00140D\/cit90\/1","doi-asserted-by":"crossref","first-page":"279","DOI":"10.1016\/0162-0134(94)85012-7","volume":"55","author":"Riddell","year":"1994","journal-title":"J. Inorg. Biochem."},{"key":"D5DD00140D\/cit91\/1","doi-asserted-by":"crossref","first-page":"782","DOI":"10.1080\/10610278.2011.593627","volume":"23","author":"Kimbrell","year":"2011","journal-title":"Supramol. Chem."},{"key":"D5DD00140D\/cit92\/1","doi-asserted-by":"crossref","first-page":"9613","DOI":"10.1021\/acs.langmuir.1c01500","volume":"37","author":"Su","year":"2021","journal-title":"Langmuir"},{"key":"D5DD00140D\/cit93\/1","doi-asserted-by":"crossref","first-page":"425","DOI":"10.1038\/s41429-023-00619-w","volume":"76","author":"Dias","year":"2023","journal-title":"J. Antibiot."},{"key":"D5DD00140D\/cit94\/1","doi-asserted-by":"crossref","first-page":"143","DOI":"10.1007\/BF01871145","volume":"40","author":"Marinetti","year":"1978","journal-title":"J. Membr. Biol."},{"key":"D5DD00140D\/cit95\/1","doi-asserted-by":"crossref","first-page":"1654","DOI":"10.1021\/ic001187y","volume":"40","author":"Wittenkeller","year":"2001","journal-title":"Inorg. Chem."},{"key":"D5DD00140D\/cit96\/1","doi-asserted-by":"crossref","first-page":"915","DOI":"10.1016\/0006-291X(92)90678-E","volume":"184","author":"Wittenkeller","year":"1992","journal-title":"Biochem. Biophys. Res. Commun."},{"key":"D5DD00140D\/cit97\/1","doi-asserted-by":"crossref","first-page":"219","DOI":"10.1016\/j.jelechem.2004.03.033","volume":"570","author":"Shirai","year":"2004","journal-title":"J. Electroanal. Chem."},{"key":"D5DD00140D\/cit98\/1","doi-asserted-by":"crossref","first-page":"1229","DOI":"10.1002\/elan.200900481","volume":"22","author":"Onishi","year":"2010","journal-title":"Electroanalysis"},{"key":"D5DD00140D\/cit99\/1","doi-asserted-by":"crossref","first-page":"165","DOI":"10.1039\/np9951200165","volume":"12","author":"Dutton","year":"1995","journal-title":"Nat. Prod. Rep."},{"key":"D5DD00140D\/cit100\/1","doi-asserted-by":"crossref","first-page":"742149","DOI":"10.1155\/2013\/742149","volume":"2013","author":"\u0141owicki","year":"2013","journal-title":"BioMed Res. Int."}],"container-title":["Digital Discovery"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/pubs.rsc.org\/en\/content\/articlepdf\/2025\/DD\/D5DD00140D","content-type":"application\/pdf","content-version":"vor","intended-application":"syndication"},{"URL":"http:\/\/pubs.rsc.org\/en\/content\/articlepdf\/2025\/DD\/D5DD00140D","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,7,2]],"date-time":"2026-07-02T04:10:53Z","timestamp":1782965453000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.rsc.org\/dd\/article\/4\/9\/2615-2626\/889054"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2025]]},"references-count":100,"journal-issue":{"issue":"9","published-print":{"date-parts":[[2025,9,10]]}},"URL":"https:\/\/doi.org\/10.1039\/d5dd00140d","relation":{},"ISSN":["2635-098X"],"issn-type":[{"value":"2635-098X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2025]]}}}