{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,2,26]],"date-time":"2026-02-26T17:38:17Z","timestamp":1772127497923,"version":"3.50.1"},"reference-count":31,"publisher":"American Chemical Society (ACS)","issue":"6","license":[{"start":{"date-parts":[[2019,6,24]],"date-time":"2019-06-24T00:00:00Z","timestamp":1561334400000},"content-version":"vor","delay-in-days":59,"URL":"http:\/\/pubs.acs.org\/page\/policy\/authorchoice_ccby_termsofuse.html"}],"funder":[{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/K038885\/1"],"award-info":[{"award-number":["EP\/K038885\/1"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/L023652\/1"],"award-info":[{"award-number":["EP\/L023652\/1"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/J015156\/1"],"award-info":[{"award-number":["EP\/J015156\/1"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/K021966\/1"],"award-info":[{"award-number":["EP\/K021966\/1"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/L015668\/1"],"award-info":[{"award-number":["EP\/L015668\/1"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100000266","name":"Engineering and Physical Sciences Research Council","doi-asserted-by":"publisher","award":["EP\/P00153X\/1"],"award-info":[{"award-number":["EP\/P00153X\/1"]}],"id":[{"id":"10.13039\/501100000266","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100010663","name":"H2020 European Research Council","doi-asserted-by":"publisher","award":["670467 SMART-POM"],"award-info":[{"award-number":["670467 SMART-POM"]}],"id":[{"id":"10.13039\/100010663","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2019,6,24]]},"DOI":"10.1021\/acs.jcim.9b00304","type":"journal-article","created":{"date-parts":[[2019,4,26]],"date-time":"2019-04-26T12:18:31Z","timestamp":1556281111000},"page":"2664-2671","source":"Crossref","is-referenced-by-count":35,"title":["Intuition-Enabled Machine Learning Beats the Competition When Joint Human-Robot Teams Perform Inorganic Chemical Experiments"],"prefix":"10.1021","volume":"59","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-8373-4362","authenticated-orcid":true,"given":"Vasilios","family":"Duros","sequence":"first","affiliation":[{"name":"School of Chemistry, University of Glasgow, University Avenue, Glasgow G12 8QQ, United Kingdom"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-2211-4389","authenticated-orcid":true,"given":"Jonathan","family":"Grizou","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Glasgow, University Avenue, Glasgow G12 8QQ, United Kingdom"}]},{"given":"Abhishek","family":"Sharma","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Glasgow, University Avenue, Glasgow G12 8QQ, United Kingdom"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-7710-3102","authenticated-orcid":true,"given":"S. Hessam M.","family":"Mehr","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Glasgow, University Avenue, Glasgow G12 8QQ, United Kingdom"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-8680-1914","authenticated-orcid":true,"given":"Andrius","family":"Bubliauskas","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Glasgow, University Avenue, Glasgow G12 8QQ, United Kingdom"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-4688-8247","authenticated-orcid":true,"given":"Przemys\u0142aw","family":"Frei","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Glasgow, University Avenue, Glasgow G12 8QQ, United Kingdom"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-0086-5173","authenticated-orcid":true,"given":"Haralampos N.","family":"Miras","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Glasgow, University Avenue, Glasgow G12 8QQ, United Kingdom"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-8035-5757","authenticated-orcid":true,"given":"Leroy","family":"Cronin","sequence":"additional","affiliation":[{"name":"School of Chemistry, University of Glasgow, University Avenue, Glasgow G12 8QQ, United Kingdom"}]}],"member":"316","published-online":{"date-parts":[[2019,4,26]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1038\/nature03193"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1038\/nrd1799"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1038\/nchem.2062"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1002\/anie.201710482"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1021\/acs.chemmater.7b05304"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1002\/minf.201600073"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1038\/nmat4395"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1021\/ci025584y"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1186\/1758-2946-3-37"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-018-0337-2"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1038\/nrd.2017.232"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1016\/j.coche.2015.07.001"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1039\/C5CS00793C"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1038\/ncomms15733"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-018-0307-8"},{"key":"ref16\/cit16","doi-asserted-by":"crossref","unstructured":"Wang, B.; Gong, N.\nZ. Stealing Hyperparameters in Machine Learning. Proceedings from the\n                      2018 IEEE Symposium on Security and Privacy (SP)\n                      , San Francisco, CA, May 20-24, 2018; IEEE: Piscataway, NJ, 2018; pp 629\u2013645.","DOI":"10.1109\/SP.2018.00038"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1002\/chem.201605499"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1038\/nature25978"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1126\/science.1165893"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1039\/B911536F"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1038\/nchem.1307"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1146\/annurev.psych.59.103006.093629"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1146\/annurev-psych-120709-145346"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1037\/a0016755"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1126\/science.185.4157.1124"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1111\/j.0956-7976.2005.00782.x"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1038\/nature17439"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1002\/anie.201705721"},{"key":"ref29\/cit29","unstructured":"Kov\u00e1cs, F.; Leg\u00e1ny, C.; Babos, A. Cluster Validity Measurement Techniques. Proceedings from the\n                      5th WSEAS International Conference on Artificial Intelligence, Knowledge Engineering and Data Bases\n                      , Madrid, Spain, February 15\u201317, 2006; World Scientific and Engineering Academy and Society (WSEAS): Stevens Point, WI, 2006; pp 1\u201311."},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1021\/ed4008765"},{"key":"ref31\/cit31","first-page":"2825","volume":"12","author":"Pedregosa F.","year":"2010","journal-title":"J. Mach. Learn. Res."}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.9b00304","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.9b00304","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,25]],"date-time":"2023-04-25T22:13:07Z","timestamp":1682460787000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.9b00304"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2019,4,26]]},"references-count":31,"journal-issue":{"issue":"6","published-print":{"date-parts":[[2019,6,24]]}},"alternative-id":["10.1021\/acs.jcim.9b00304"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.9b00304","relation":{"has-preprint":[{"id-type":"doi","id":"10.26434\/chemrxiv.7712453.v1","asserted-by":"object"}]},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2019,4,26]]}}}