{"id":"https://openalex.org/W2045873232","doi":"https://doi.org/10.1021/ci00017a013","title":"Computation and management of chemical properties in CACTVS: An extensible networked approach toward modularity and compatibility","display_name":"Computation and management of chemical properties in CACTVS: An extensible networked approach toward modularity and compatibility","publication_year":1994,"publication_date":"1994-01-01","ids":{"openalex":"https://openalex.org/W2045873232","doi":"https://doi.org/10.1021/ci00017a013","mag":"2045873232"},"language":"en","primary_location":{"id":"doi:10.1021/ci00017a013","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci00017a013","pdf_url":null,"source":{"id":"https://openalex.org/S171559003","display_name":"Journal of Chemical Information and Computer Sciences","issn_l":"0095-2338","issn":["0095-2338","1520-5142"],"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":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Computer Sciences","raw_type":"journal-article"},"type":"article","indexed_in":["crossref"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5110086822","display_name":"W.D. Ihlenfeldt","orcid":null},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"Wolf Dietrich Ihlenfeldt","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5107677765","display_name":"Yoshimasa TAKAHASHI","orcid":"https://orcid.org/0000-0002-3377-3320"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Yoshimasa Takahashi","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5110060515","display_name":"Hidetsugu Abe","orcid":null},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Hidetsugu Abe","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"last","author":{"id":"https://openalex.org/A5076137369","display_name":"Satoshi Sasaki","orcid":"https://orcid.org/0000-0003-3643-1649"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"S. Sasaki","raw_affiliation_strings":[],"affiliations":[]}],"institutions":[],"countries_distinct_count":0,"institutions_distinct_count":4,"corresponding_author_ids":["https://openalex.org/A5110086822"],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":1.0021,"has_fulltext":false,"cited_by_count":151,"citation_normalized_percentile":{"value":0.74326568,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":90,"max":100},"biblio":{"volume":"34","issue":"1","first_page":"109","last_page":"116"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11948","display_name":"Machine Learning in Materials Science","score":0.9153000116348267,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T11948","display_name":"Machine Learning in Materials Science","score":0.9153000116348267,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/compatibility","display_name":"Compatibility (geochemistry)","score":0.8516937494277954},{"id":"https://openalex.org/keywords/modularity","display_name":"Modularity (biology)","score":0.8314300775527954},{"id":"https://openalex.org/keywords/extensibility","display_name":"Extensibility","score":0.7649084329605103},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.6715191602706909},{"id":"https://openalex.org/keywords/computation","display_name":"Computation","score":0.6611423492431641},{"id":"https://openalex.org/keywords/encapsulation","display_name":"Encapsulation (networking)","score":0.4321928024291992},{"id":"https://openalex.org/keywords/distributed-computing","display_name":"Distributed computing","score":0.4211786389350891},{"id":"https://openalex.org/keywords/theoretical-computer-science","display_name":"Theoretical computer science","score":0.3677380383014679},{"id":"https://openalex.org/keywords/software-engineering","display_name":"Software engineering","score":0.3283035159111023},{"id":"https://openalex.org/keywords/programming-language","display_name":"Programming language","score":0.2923312783241272},{"id":"https://openalex.org/keywords/engineering","display_name":"Engineering","score":0.140647292137146},{"id":"https://openalex.org/keywords/computer-network","display_name":"Computer network","score":0.12428387999534607},{"id":"https://openalex.org/keywords/chemical-engineering","display_name":"Chemical engineering","score":0.08075055480003357}],"concepts":[{"id":"https://openalex.org/C2778648169","wikidata":"https://www.wikidata.org/wiki/Q967768","display_name":"Compatibility (geochemistry)","level":2,"score":0.8516937494277954},{"id":"https://openalex.org/C2779478453","wikidata":"https://www.wikidata.org/wiki/Q6889748","display_name":"Modularity (biology)","level":2,"score":0.8314300775527954},{"id":"https://openalex.org/C32833848","wikidata":"https://www.wikidata.org/wiki/Q4115054","display_name":"Extensibility","level":2,"score":0.7649084329605103},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.6715191602706909},{"id":"https://openalex.org/C45374587","wikidata":"https://www.wikidata.org/wiki/Q12525525","display_name":"Computation","level":2,"score":0.6611423492431641},{"id":"https://openalex.org/C81147070","wikidata":"https://www.wikidata.org/wiki/Q1172449","display_name":"Encapsulation (networking)","level":2,"score":0.4321928024291992},{"id":"https://openalex.org/C120314980","wikidata":"https://www.wikidata.org/wiki/Q180634","display_name":"Distributed computing","level":1,"score":0.4211786389350891},{"id":"https://openalex.org/C80444323","wikidata":"https://www.wikidata.org/wiki/Q2878974","display_name":"Theoretical computer science","level":1,"score":0.3677380383014679},{"id":"https://openalex.org/C115903868","wikidata":"https://www.wikidata.org/wiki/Q80993","display_name":"Software engineering","level":1,"score":0.3283035159111023},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.2923312783241272},{"id":"https://openalex.org/C127413603","wikidata":"https://www.wikidata.org/wiki/Q11023","display_name":"Engineering","level":0,"score":0.140647292137146},{"id":"https://openalex.org/C31258907","wikidata":"https://www.wikidata.org/wiki/Q1301371","display_name":"Computer network","level":1,"score":0.12428387999534607},{"id":"https://openalex.org/C42360764","wikidata":"https://www.wikidata.org/wiki/Q83588","display_name":"Chemical engineering","level":1,"score":0.08075055480003357},{"id":"https://openalex.org/C54355233","wikidata":"https://www.wikidata.org/wiki/Q7162","display_name":"Genetics","level":1,"score":0.0},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1021/ci00017a013","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci00017a013","pdf_url":null,"source":{"id":"https://openalex.org/S171559003","display_name":"Journal of Chemical Information and Computer Sciences","issn_l":"0095-2338","issn":["0095-2338","1520-5142"],"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":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Computer Sciences","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":0,"referenced_works":[],"related_works":["https://openalex.org/W2277514059","https://openalex.org/W1948607442","https://openalex.org/W3004004161","https://openalex.org/W2044615423","https://openalex.org/W4247766898","https://openalex.org/W4244765761","https://openalex.org/W2361584951","https://openalex.org/W2365327041","https://openalex.org/W2500556566","https://openalex.org/W2183101619"],"abstract_inverted_index":{"ADVERTISEMENT":[0],"RETURN":[1],"TO":[2],"ISSUEPREVArticleNEXTComputation":[3],"and":[4,17,25,73,78,107,151,168,184,186],"management":[5],"of":[6,63,98,124],"chemical":[7],"properties":[8],"in":[9],"CACTVS:":[10],"An":[11],"extensible":[12],"networked":[13],"approach":[14],"toward":[15],"modularity":[16],"compatibilityWolf":[18],"Dietrich":[19],"Ihlenfeldt,":[20],"Yoshimasa":[21],"Takahashi,":[22],"Hidetsugu":[23],"Abe,":[24],"S.":[26],"SasakiCite":[27],"this:":[28],"J.":[29],"Chem.":[30],"Inf.":[31],"Comput.":[32],"Sci.":[33],"1994,":[34],"34,":[35],"1,":[36,40],"109\u2013116Publication":[37],"Date":[38],"(Print):January":[39],"1994Publication":[41],"History":[42],"Published":[43],"online1":[44],"May":[45],"2002Published":[46],"inissue":[47],"1":[48],"January":[49],"1994https://pubs.acs.org/doi/10.1021/ci00017a013https://doi.org/10.1021/ci00017a013research-articleACS":[50],"PublicationsRequest":[51],"reuse":[52],"permissionsArticle":[53],"Views306Altmetric-Citations125LEARN":[54],"ABOUT":[55],"THESE":[56],"METRICSArticle":[57],"Views":[58],"are":[59,82,95],"the":[60,91,96,125,136,149,152,157,164,170],"COUNTER-compliant":[61],"sum":[62],"full":[64],"text":[65],"article":[66,130],"downloads":[67],"since":[68],"November":[69],"2008":[70],"(both":[71],"PDF":[72],"HTML)":[74],"across":[75],"all":[76],"institutions":[77],"individuals.":[79],"These":[80],"metrics":[81],"regularly":[83],"updated":[84,108],"to":[85,90],"reflect":[86],"usage":[87],"leading":[88],"up":[89],"last":[92],"few":[93],"days.Citations":[94],"number":[97],"other":[99],"articles":[100],"citing":[101],"this":[102],"article,":[103],"calculated":[104],"by":[105],"Crossref":[106,114],"daily.":[109],"Find":[110,160],"more":[111,161],"information":[112,162],"about":[113,148],"citation":[115],"counts.The":[116],"Altmetric":[117,165],"Attention":[118,166],"Score":[119,167],"is":[120,172],"a":[121,128,141],"quantitative":[122],"measure":[123],"attention":[126],"that":[127],"research":[129],"has":[131],"received":[132],"online.":[133],"Clicking":[134],"on":[135,163],"donut":[137],"icon":[138],"will":[139],"load":[140],"page":[142],"at":[143],"altmetric.com":[144],"with":[145,180],"additional":[146],"details":[147],"score":[150,171],"social":[153],"media":[154],"presence":[155],"for":[156],"given":[158],"article.":[159],"how":[169],"calculated.":[173],"Share":[174,189],"Add":[175],"toView":[176],"InAdd":[177],"Full":[178],"Text":[179],"ReferenceAdd":[181],"Description":[182],"ExportRISCitationCitation":[183],"abstractCitation":[185],"referencesMore":[187],"Options":[188],"onFacebookTwitterWechatLinked":[190],"InRedditEmail":[191],"Other":[192],"access":[193],"options":[194],"Get":[195],"e-Alerts":[196]},"counts_by_year":[{"year":2026,"cited_by_count":3},{"year":2025,"cited_by_count":1},{"year":2024,"cited_by_count":10},{"year":2023,"cited_by_count":5},{"year":2022,"cited_by_count":7},{"year":2021,"cited_by_count":7},{"year":2020,"cited_by_count":7},{"year":2019,"cited_by_count":10},{"year":2018,"cited_by_count":9},{"year":2017,"cited_by_count":1},{"year":2016,"cited_by_count":4},{"year":2015,"cited_by_count":5},{"year":2014,"cited_by_count":5},{"year":2013,"cited_by_count":8},{"year":2012,"cited_by_count":10}],"updated_date":"2026-04-02T15:55:50.835912","created_date":"2025-10-10T00:00:00"}
