{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,1,12]],"date-time":"2026-01-12T23:34:42Z","timestamp":1768260882147,"version":"3.49.0"},"reference-count":48,"publisher":"American Chemical Society (ACS)","issue":"1","funder":[{"DOI":"10.13039\/501100002347","name":"Bundesministerium f\u00fcr Bildung und Forschung","doi-asserted-by":"publisher","award":["031A1838"],"award-info":[{"award-number":["031A1838"]}],"id":[{"id":"10.13039\/501100002347","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2016,1,25]]},"DOI":"10.1021\/acs.jcim.5b00588","type":"journal-article","created":{"date-parts":[[2016,1,13]],"date-time":"2016-01-13T12:52:34Z","timestamp":1452689554000},"page":"248-259","source":"Crossref","is-referenced-by-count":48,"title":["SIENA: Efficient Compilation of Selective Protein Binding Site Ensembles"],"prefix":"10.1021","volume":"56","author":[{"given":"Stefan","family":"Bietz","sequence":"first","affiliation":[{"name":"Center for Bioinformatics, University of Hamburg, Bundesstrasse 43, 20146 Hamburg, Germany"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Matthias","family":"Rarey","sequence":"additional","affiliation":[{"name":"Center for Bioinformatics, University of Hamburg, Bundesstrasse 43, 20146 Hamburg, Germany"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2016,1,13]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1021\/jm049756p"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1021\/jm048972v"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1021\/ci900407c"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0018845"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1021\/ci200257b"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1021\/ci300390h"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1021\/ci2005934"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1016\/j.febslet.2004.03.067"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1110\/ps.041153605"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/bts395"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1021\/jm990322h"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1021\/ja0709728"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1002\/prot.20928"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1517\/17460441.1.2.179"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1074\/mcp.M400159-MCP200"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkr825"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/28.1.235"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btt405"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gkq1181"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1021\/ci8002254"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1021\/jm061277y"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1002\/(SICI)1097-0134(19990215)34:3<269::AID-PROT1>3.0.CO;2-3"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1021\/jm8001197"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1007\/s10822-007-9159-2"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1021\/ci100457t"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1021\/ci400729j"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.0805820105"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1002\/prot.22214"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1021\/ci200168b"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1021\/ci3004557"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1021\/ci9003943"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1021\/ci200428t"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.85.8.2444"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1016\/S0022-2836(05)80360-2"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1101\/gr.229202"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.5b00210"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1021\/ci400724v"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1021\/ci00062a008"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1186\/1758-2946-6-12"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1006\/jmbi.1996.0477"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1007\/s10822-012-9626-2"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1093\/protein\/10.6.737"},{"key":"ref43\/cit43","unstructured":"PDB Advanced Search.http:\/\/www.pdb.org\/pdb\/search\/advSearch.do?search\/new(accessed Sep 16, 2015) ."},{"key":"ref44\/cit44","unstructured":"PDB Growth Statistics.http:\/\/www.rcsb.org\/pdb\/statistics\/contentGrowthChart.do?content\/total&seqid\/100(accessed Sep 16, 2015) ."},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M609151200"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/gku928"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1021\/ja042260c"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1007\/s00249-010-0592-0"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.5b00588","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,17]],"date-time":"2023-04-17T10:21:19Z","timestamp":1681726879000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.5b00588"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2016,1,13]]},"references-count":48,"journal-issue":{"issue":"1","published-print":{"date-parts":[[2016,1,25]]}},"alternative-id":["10.1021\/acs.jcim.5b00588"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.5b00588","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2016,1,13]]}}}