{"id":"https://openalex.org/W2886184108","doi":"https://doi.org/10.1021/acs.jcim.8b00489","title":"Addendum to BiKi Life Sciences: A New Suite for Molecular Dynamics and Related Methods in Drug Discovery","display_name":"Addendum to BiKi Life Sciences: A New Suite for Molecular Dynamics and Related Methods in Drug Discovery","publication_year":2018,"publication_date":"2018-08-03","ids":{"openalex":"https://openalex.org/W2886184108","doi":"https://doi.org/10.1021/acs.jcim.8b00489","mag":"2886184108","pmid":"https://pubmed.ncbi.nlm.nih.gov/30074778"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jcim.8b00489","is_oa":true,"landing_page_url":"https://doi.org/10.1021/acs.jcim.8b00489","pdf_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.8b00489","source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":"publisher-specific-oa","license_id":"https://openalex.org/licenses/publisher-specific-oa","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},"type":"erratum","indexed_in":["crossref","pubmed"],"open_access":{"is_oa":true,"oa_status":"bronze","oa_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.8b00489","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5004937122","display_name":"Sergio Decherchi","orcid":"https://orcid.org/0000-0001-8371-2270"},"institutions":[{"id":"https://openalex.org/I30771326","display_name":"Italian Institute of Technology","ror":"https://ror.org/042t93s57","country_code":"IT","type":"facility","lineage":["https://openalex.org/I30771326"]}],"countries":["IT"],"is_corresponding":true,"raw_author_name":"Sergio Decherchi","raw_affiliation_strings":["BiKi Technologies s.r.l, Via XX Settembre, n. 33/10, 16121 Genova, Italy","Computational Sciences, Istituto Italiano di Tecnologia, Via Morego 30, 16163 Genova, Italy"],"affiliations":[{"raw_affiliation_string":"BiKi Technologies s.r.l, Via XX Settembre, n. 33/10, 16121 Genova, Italy","institution_ids":[]},{"raw_affiliation_string":"Computational Sciences, Istituto Italiano di Tecnologia, Via Morego 30, 16163 Genova, Italy","institution_ids":["https://openalex.org/I30771326"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5076090370","display_name":"Giovanni Bottegoni","orcid":"https://orcid.org/0000-0003-1251-583X"},"institutions":[{"id":"https://openalex.org/I4210147697","display_name":"Heptares Therapeutics (United Kingdom)","ror":"https://ror.org/051fk5x88","country_code":"GB","type":"company","lineage":["https://openalex.org/I4210147697"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Giovanni Bottegoni","raw_affiliation_strings":["Heptares Therapeutics Ltd, BioPark, Broadwater Road, Welwyn Garden City, U.K"],"affiliations":[{"raw_affiliation_string":"Heptares Therapeutics Ltd, BioPark, Broadwater Road, Welwyn Garden City, U.K","institution_ids":["https://openalex.org/I4210147697"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5049162857","display_name":"Andrea Spitaleri","orcid":"https://orcid.org/0000-0003-3012-3557"},"institutions":[{"id":"https://openalex.org/I30771326","display_name":"Italian Institute of Technology","ror":"https://ror.org/042t93s57","country_code":"IT","type":"facility","lineage":["https://openalex.org/I30771326"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Andrea Spitaleri","raw_affiliation_strings":["BiKi Technologies s.r.l, Via XX Settembre, n. 33/10, 16121 Genova, Italy","Concept Lab, Istituto Italiano di Tecnologia, Via Morego 30, 16163 Genova, Italy"],"affiliations":[{"raw_affiliation_string":"BiKi Technologies s.r.l, Via XX Settembre, n. 33/10, 16121 Genova, Italy","institution_ids":[]},{"raw_affiliation_string":"Concept Lab, Istituto Italiano di Tecnologia, Via Morego 30, 16163 Genova, Italy","institution_ids":["https://openalex.org/I30771326"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5089704088","display_name":"Walter Rocchia","orcid":"https://orcid.org/0000-0003-2480-7151"},"institutions":[{"id":"https://openalex.org/I30771326","display_name":"Italian Institute of Technology","ror":"https://ror.org/042t93s57","country_code":"IT","type":"facility","lineage":["https://openalex.org/I30771326"]}],"countries":["IT"],"is_corresponding":true,"raw_author_name":"Walter Rocchia","raw_affiliation_strings":["Concept Lab, Istituto Italiano di Tecnologia, Via Morego 30, 16163 Genova, Italy"],"affiliations":[{"raw_affiliation_string":"Concept Lab, Istituto Italiano di Tecnologia, Via Morego 30, 16163 Genova, Italy","institution_ids":["https://openalex.org/I30771326"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5021953983","display_name":"Andrea Cavalli","orcid":"https://orcid.org/0000-0002-6370-1176"},"institutions":[{"id":"https://openalex.org/I30771326","display_name":"Italian Institute of Technology","ror":"https://ror.org/042t93s57","country_code":"IT","type":"facility","lineage":["https://openalex.org/I30771326"]},{"id":"https://openalex.org/I9360294","display_name":"University of Bologna","ror":"https://ror.org/01111rn36","country_code":"IT","type":"education","lineage":["https://openalex.org/I9360294"]}],"countries":["IT"],"is_corresponding":true,"raw_author_name":"Andrea Cavalli","raw_affiliation_strings":["Computational Sciences, Istituto Italiano di Tecnologia, Via Morego 30, 16163 Genova, Italy","Department of Pharmacy and Biotechnology, University of Bologna, Via Belmeloro 6, 40126 Bologna, Italy"],"affiliations":[{"raw_affiliation_string":"Computational Sciences, Istituto Italiano di Tecnologia, Via Morego 30, 16163 Genova, Italy","institution_ids":["https://openalex.org/I30771326"]},{"raw_affiliation_string":"Department of Pharmacy and Biotechnology, University of Bologna, Via Belmeloro 6, 40126 Bologna, Italy","institution_ids":["https://openalex.org/I9360294"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":5,"corresponding_author_ids":["https://openalex.org/A5004937122","https://openalex.org/A5021953983","https://openalex.org/A5089704088"],"corresponding_institution_ids":["https://openalex.org/I30771326","https://openalex.org/I9360294"],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":{"value":0.12801233,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"58","issue":"8","first_page":"1721","last_page":"1721"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.998199999332428,"subfield":{"id":"https://openalex.org/subfields/1703","display_name":"Computational Theory and Mathematics"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.998199999332428,"subfield":{"id":"https://openalex.org/subfields/1703","display_name":"Computational Theory and Mathematics"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10044","display_name":"Protein Structure and Dynamics","score":0.9977999925613403,"subfield":{"id":"https://openalex.org/subfields/1312","display_name":"Molecular Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T10521","display_name":"RNA and protein synthesis mechanisms","score":0.9926000237464905,"subfield":{"id":"https://openalex.org/subfields/1312","display_name":"Molecular Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/addendum","display_name":"Addendum","score":0.5462008714675903},{"id":"https://openalex.org/keywords/humanities","display_name":"Humanities","score":0.46651092171669006},{"id":"https://openalex.org/keywords/library-science","display_name":"Library science","score":0.40277010202407837},{"id":"https://openalex.org/keywords/art","display_name":"Art","score":0.3342767655849457},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.21458932757377625},{"id":"https://openalex.org/keywords/philosophy","display_name":"Philosophy","score":0.14162006974220276}],"concepts":[{"id":"https://openalex.org/C2778945725","wikidata":"https://www.wikidata.org/wiki/Q352858","display_name":"Addendum","level":2,"score":0.5462008714675903},{"id":"https://openalex.org/C15708023","wikidata":"https://www.wikidata.org/wiki/Q80083","display_name":"Humanities","level":1,"score":0.46651092171669006},{"id":"https://openalex.org/C161191863","wikidata":"https://www.wikidata.org/wiki/Q199655","display_name":"Library science","level":1,"score":0.40277010202407837},{"id":"https://openalex.org/C142362112","wikidata":"https://www.wikidata.org/wiki/Q735","display_name":"Art","level":0,"score":0.3342767655849457},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.21458932757377625},{"id":"https://openalex.org/C138885662","wikidata":"https://www.wikidata.org/wiki/Q5891","display_name":"Philosophy","level":0,"score":0.14162006974220276},{"id":"https://openalex.org/C41895202","wikidata":"https://www.wikidata.org/wiki/Q8162","display_name":"Linguistics","level":1,"score":0.0}],"mesh":[],"locations_count":4,"locations":[{"id":"doi:10.1021/acs.jcim.8b00489","is_oa":true,"landing_page_url":"https://doi.org/10.1021/acs.jcim.8b00489","pdf_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.8b00489","source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":"publisher-specific-oa","license_id":"https://openalex.org/licenses/publisher-specific-oa","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},{"id":"pmid:30074778","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/30074778","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of chemical information and modeling","raw_type":null},{"id":"pmh:oai:air.unimi.it:2434/1041644","is_oa":true,"landing_page_url":"https://hdl.handle.net/2434/1041644","pdf_url":null,"source":{"id":"https://openalex.org/S4306400516","display_name":"Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I189158943","host_organization_name":"University of Milan","host_organization_lineage":["https://openalex.org/I189158943"],"host_organization_lineage_names":[],"type":"repository"},"license":"other-oa","license_id":"https://openalex.org/licenses/other-oa","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"info:eu-repo/semantics/article"},{"id":"pmh:oai:zenodo.org:91567","is_oa":true,"landing_page_url":"https://www.openaccessrepository.it/record/91567","pdf_url":null,"source":{"id":"https://openalex.org/S4306402478","display_name":"INFM-OAR (INFN Catania)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I4210116497","host_organization_name":"Istituto Nazionale di Fisica Nucleare, Sezione di Catania","host_organization_lineage":["https://openalex.org/I4210116497"],"host_organization_lineage_names":[],"type":"repository"},"license":"other-oa","license_id":"https://openalex.org/licenses/other-oa","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"","raw_type":"info:eu-repo/semantics/article"}],"best_oa_location":{"id":"doi:10.1021/acs.jcim.8b00489","is_oa":true,"landing_page_url":"https://doi.org/10.1021/acs.jcim.8b00489","pdf_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.8b00489","source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":"publisher-specific-oa","license_id":"https://openalex.org/licenses/publisher-specific-oa","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"pdf":true,"grobid_xml":true},"content_urls":{"pdf":"https://content.openalex.org/works/W2886184108.pdf","grobid_xml":"https://content.openalex.org/works/W2886184108.grobid-xml"},"referenced_works_count":1,"referenced_works":["https://openalex.org/W2783337342"],"related_works":["https://openalex.org/W4387497383","https://openalex.org/W3183948672","https://openalex.org/W3173606202","https://openalex.org/W3110381201","https://openalex.org/W2948807893","https://openalex.org/W2935909890","https://openalex.org/W2778153218","https://openalex.org/W2758277628","https://openalex.org/W2748952813","https://openalex.org/W1531601525"],"abstract_inverted_index":{"RETURN":[0],"TO":[1],"ISSUEPREVErratumNEXTORIGINAL":[2],"ARTICLEThis":[3],"notice":[4],"is":[5,236,288],"a":[6,237,244,257],"correctionAddendum":[7],"to":[8,201,206],"BiKi":[9],"Life":[10],"Sciences:":[11],"A":[12],"New":[13],"Suite":[14],"for":[15,272],"Molecular":[16],"Dynamics":[17],"and":[18,109,126,189,194,223,267,284,300,302],"Related":[19],"Methods":[20],"in":[21],"Drug":[22],"DiscoverySergio":[23],"Decherchi*Sergio":[24],"DecherchiComputational":[25],"Sciences,":[26,113],"Istituto":[27,69,96,114],"Italiano":[28,70,97,115],"di":[29,71,98,116],"Tecnologia,":[30,72,99,117],"Via":[31,39,73,81,100,118,131],"Morego":[32,74,101,119],"30,":[33,75,102,120],"16163":[34,76,103,121],"Genova,":[35,45,77,87,104,122],"ItalyBiKi":[36,78],"Technologies":[37,79],"s.r.l,":[38,80],"XX":[40,82],"Settembre,":[41,83],"n.":[42,84],"33/10,":[43,85],"16121":[44,86],"ItalyMore":[46,88,105,136],"by":[47,62,89,106,137,221],"Sergio":[48],"Decherchi,":[49],"Giovanni":[50,63],"BottegoniGiovanni":[51],"BottegoniHeptares":[52],"Therapeutics":[53],"Ltd,":[54],"BioPark,":[55],"Broadwater":[56],"Road,":[57],"Welwyn":[58],"Garden":[59],"City,":[60],"U.K.More":[61],"Bottegonihttp://orcid.org/0000-0003-1251-583X,":[64],"Andrea":[65,90,110,138],"SpitaleriAndrea":[66],"SpitaleriConcept":[67],"Lab,":[68,95],"Spitalerihttp://orcid.org/0000-0003-3012-3557,":[91],"Walter":[92,107],"Rocchia*Walter":[93],"RocchiaConcept":[94],"Rocchiahttp://orcid.org/0000-0003-2480-7151,":[108],"Cavalli*Andrea":[111],"CavalliComputational":[112],"ItalyDepartment":[123],"of":[124,129,179,214,240],"Pharmacy":[125],"Biotechnology,":[127],"University":[128],"Bologna,":[130,135],"Belmeloro":[132],"6,":[133],"40126":[134],"Cavallihttp://orcid.org/0000-0002-6370-1176Cite":[139],"this:":[140],"J.":[141],"Chem.":[142],"Inf.":[143],"Model.":[144],"2018,":[145],"58,":[146],"8,":[147],"1721Publication":[148],"Date":[149],"(Web):August":[150],"3,":[151],"2018Publication":[152],"History":[153],"Published":[154],"online3":[155],"August":[156,160],"2018Published":[157],"inissue":[158],"27":[159],"2018https://doi.org/10.1021/acs.jcim.8b00489Copyright":[161],"\u00a9":[162],"2018":[163],"American":[164],"Chemical":[165],"SocietyRIGHTS":[166],"&":[167],"PERMISSIONSACS":[168],"AuthorChoiceArticle":[169],"Views869Altmetric-Citations-LEARN":[170],"ABOUT":[171],"THESE":[172],"METRICSArticle":[173],"Views":[174],"are":[175,198,211],"the":[176,207,212,241,252,265,268,273,280,286],"COUNTER-compliant":[177],"sum":[178],"full":[180],"text":[181],"article":[182,246],"downloads":[183],"since":[184],"November":[185],"2008":[186],"(both":[187],"PDF":[188,308],"HTML)":[190],"across":[191],"all":[192],"institutions":[193],"individuals.":[195],"These":[196],"metrics":[197],"regularly":[199],"updated":[200,224],"reflect":[202],"usage":[203],"leading":[204],"up":[205],"last":[208],"few":[209],"days.Citations":[210],"number":[213],"other":[215],"articles":[216],"citing":[217],"this":[218],"article,":[219],"calculated":[220],"Crossref":[222,230],"daily.":[225],"Find":[226,276],"more":[227,277],"information":[228,278],"about":[229,264],"citation":[231],"counts.The":[232],"Altmetric":[233,281],"Attention":[234,282],"Score":[235,283],"quantitative":[238],"measure":[239],"attention":[242],"that":[243],"research":[245],"has":[247],"received":[248],"online.":[249],"Clicking":[250],"on":[251,279],"donut":[253],"icon":[254],"will":[255],"load":[256],"page":[258],"at":[259],"altmetric.com":[260],"with":[261,296],"additional":[262],"details":[263],"score":[266,287],"social":[269],"media":[270],"presence":[271],"given":[274],"article.":[275],"how":[285],"calculated.":[289],"Share":[290,305],"Add":[291],"toView":[292],"InAdd":[293],"Full":[294],"Text":[295],"ReferenceAdd":[297],"Description":[298],"ExportRISCitationCitation":[299],"abstractCitation":[301],"referencesMore":[303],"Options":[304],"onFacebookTwitterWechatLinked":[306],"InReddit":[307],"(336":[309],"KB)":[310],"Get":[311,313],"e-Alerts":[312,314]},"counts_by_year":[],"updated_date":"2026-03-27T05:58:40.876381","created_date":"2025-10-10T00:00:00"}