{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,4,7]],"date-time":"2026-04-07T00:24:54Z","timestamp":1775521494317,"version":"3.50.1"},"reference-count":34,"publisher":"American Chemical Society (ACS)","issue":"6","license":[{"start":{"date-parts":[[2021,5,20]],"date-time":"2021-05-20T00:00:00Z","timestamp":1621468800000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2021,5,20]],"date-time":"2021-05-20T00:00:00Z","timestamp":1621468800000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2021,5,20]],"date-time":"2021-05-20T00:00:00Z","timestamp":1621468800000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/100000054","name":"National Cancer Institute","doi-asserted-by":"publisher","award":["U01CA207160"],"award-info":[{"award-number":["U01CA207160"]}],"id":[{"id":"10.13039\/100000054","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100009432","name":"Government Council on Grants, Russian Federation","doi-asserted-by":"publisher","id":[{"id":"10.13039\/501100009432","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100003593","name":"Conselho Nacional de Desenvolvimento Cient?fico e Tecnol?gico","doi-asserted-by":"publisher","award":["309648\/2019-0"],"award-info":[{"award-number":["309648\/2019-0"]}],"id":[{"id":"10.13039\/501100003593","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100003593","name":"Conselho Nacional de Desenvolvimento Cient?fico e Tecnol?gico","doi-asserted-by":"publisher","award":["431254\/2018-4"],"award-info":[{"award-number":["431254\/2018-4"]}],"id":[{"id":"10.13039\/501100003593","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2021,6,28]]},"DOI":"10.1021\/acs.jcim.1c00083","type":"journal-article","created":{"date-parts":[[2021,5,20]],"date-time":"2021-05-20T18:15:04Z","timestamp":1621534504000},"page":"2516-2522","source":"Crossref","is-referenced-by-count":25,"title":["The SistematX Web Portal of Natural Products: An Update"],"prefix":"10.1021","volume":"61","author":[{"given":"Renan P. O.","family":"Costa","sequence":"first","affiliation":[{"name":"Laboratory of Cheminformatics, Instituto de Pesquisa em F\u00e1rmacos e Medicamentos (IPeFarM), Universidade Federal da Para\u00edba, Campus I, Cidade Universit\u00e1ria, Jo\u00e3o Pessoa 58051-900, PB, Brazil"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Lucas F.","family":"Lucena","sequence":"additional","affiliation":[{"name":"Laboratory of Cheminformatics, Instituto de Pesquisa em F\u00e1rmacos e Medicamentos (IPeFarM), Universidade Federal da Para\u00edba, Campus I, Cidade Universit\u00e1ria, Jo\u00e3o Pessoa 58051-900, PB, Brazil"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Lorena Mara A.","family":"Silva","sequence":"additional","affiliation":[{"name":"Laborat\u00f3rio Multiusu\u00e1rio de Qu\u00edmica de Produtos Naturais, Embrapa Agroind\u00fastria Tropical, Rua Doutora Sara Mesquita 2270, Planalto do Pici, Fortaleza 60511110, CE, Brazil"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-8835-0184","authenticated-orcid":true,"given":"Guilherme Juli\u00e3o","family":"Zocolo","sequence":"additional","affiliation":[{"name":"Laborat\u00f3rio Multiusu\u00e1rio de Qu\u00edmica de Produtos Naturais, Embrapa Agroind\u00fastria Tropical, Rua Doutora Sara Mesquita 2270, Planalto do Pici, Fortaleza 60511110, CE, Brazil"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Chonny","family":"Herrera-Acevedo","sequence":"additional","affiliation":[{"name":"Laboratory of Cheminformatics, Instituto de Pesquisa em F\u00e1rmacos e Medicamentos (IPeFarM), Universidade Federal da Para\u00edba, Campus I, Cidade Universit\u00e1ria, Jo\u00e3o Pessoa 58051-900, PB, Brazil"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Luciana","family":"Scotti","sequence":"additional","affiliation":[{"name":"Laboratory of Cheminformatics, Instituto de Pesquisa em F\u00e1rmacos e Medicamentos (IPeFarM), Universidade Federal da Para\u00edba, Campus I, Cidade Universit\u00e1ria, Jo\u00e3o Pessoa 58051-900, PB, Brazil"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-2345-5804","authenticated-orcid":true,"given":"Fernando Batista","family":"Da-Costa","sequence":"additional","affiliation":[{"name":"AsterBioChem Research Team, Laboratory of Pharmacognosy, School of Pharmaceutical Sciences of Ribeir\u00e3o Preto, University of S\u00e3o Paulo, Av do caf\u00e9 s\/n, Ribeir\u00e3o Preto 14040-903, SP, Brazil"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Nikita","family":"Ionov","sequence":"additional","affiliation":[{"name":"Laboratory of Structure\u2212Function Based Drug Design, Department of Bioinformatics, Institute of Biomedical Chemistry, Pogodinskaya Str. 10, bldg. 8, Moscow 119121, Russia"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-7937-2621","authenticated-orcid":true,"given":"Vladimir","family":"Poroikov","sequence":"additional","affiliation":[{"name":"Laboratory of Structure\u2212Function Based Drug Design, Department of Bioinformatics, Institute of Biomedical Chemistry, Pogodinskaya Str. 10, bldg. 8, Moscow 119121, Russia"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-4616-7036","authenticated-orcid":true,"given":"Eugene N.","family":"Muratov","sequence":"additional","affiliation":[{"name":"Eshelman School of Pharmacy, University of North Carolina, Chapel Hill, North Carolina 27599, United States"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-4863-8057","authenticated-orcid":true,"given":"Marcus T.","family":"Scotti","sequence":"additional","affiliation":[{"name":"Laboratory of Cheminformatics, Instituto de Pesquisa em F\u00e1rmacos e Medicamentos (IPeFarM), Universidade Federal da Para\u00edba, Campus I, Cidade Universit\u00e1ria, Jo\u00e3o Pessoa 58051-900, PB, Brazil"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2021,5,20]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.3390\/biom10111566"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1002\/minf.202000171"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1186\/s13321-020-00478-9"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1021\/ci049714+"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gku886"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1186\/s13321-020-00424-9"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.3390\/molecules23010103"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1021\/ci100176x"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1002\/9781118794623.ch22"},{"key":"ref10\/cit10","unstructured":"ChemAxon. Marvin JS. http:\/\/chemaxon.com\/products\/marvin\/marvin-js\/ (accessed 24 July 2020)."},{"key":"ref11\/cit11","unstructured":"ChemAxon. Jchem Engines. http:\/\/chemaxon.com\/products\/jchem-web-services\/ (accessed 25 July 2020)."},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1007\/s11030-020-10139-6"},{"key":"ref13\/cit13","volume-title":"Advanced web metrics with Google Analytics","author":"Clifton B.","year":"2012","edition":"3"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1002\/cmdc.201700743"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.2174\/1568026620666200716114546"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.3390\/molecules24213908"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.21577\/0100-4042.20170499"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1002\/elps.201800428"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1007\/s11306-019-1520-7"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.RA118.006025"},{"key":"ref21\/cit21","volume-title":"The Java programming language","volume":"2","author":"Arnold K.","year":"2000","edition":"3"},{"key":"ref22\/cit22","unstructured":"Oracle. MySQL. http:\/\/dev.mysql.com\/downloads\/mysql\/ (accessed 03 July 2020)."},{"key":"ref23\/cit23","unstructured":"The Apache Software\nFoundation. Tomcat 8. https:\/\/tomcat.apache.org\/tomcat-8.0-doc\/config\/http.html (accessed\n20 July 2020)."},{"key":"ref24\/cit24","unstructured":"iChemLabs. ChemDoodle. http:\/\/web.chemdoodle.com\/ (accessed 28 July 2020)."},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1021\/ci300309k"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1021\/np3006875"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0015939"},{"key":"ref28\/cit28","unstructured":"AsterBioChem. AsterDB. http:\/\/www.asterbiochem.org\/asterdb (accessed 14 July 2020)."},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1021\/ac010737m"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1021\/ci034228s"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1021\/ci700172n"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1007\/s10593-014-1496-1"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1007\/s11172-019-2683-0"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.3389\/fchem.2018.00133"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.1c00083","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,26]],"date-time":"2023-04-26T04:32:22Z","timestamp":1682483542000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.1c00083"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2021,5,20]]},"references-count":34,"journal-issue":{"issue":"6","published-print":{"date-parts":[[2021,6,28]]}},"alternative-id":["10.1021\/acs.jcim.1c00083"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.1c00083","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2021,5,20]]}}}