{"id":"https://openalex.org/W2029007309","doi":"https://doi.org/10.1021/ci00037a008","title":"Conformation specification of chemical structures in computer programs","display_name":"Conformation specification of chemical structures in computer programs","publication_year":1983,"publication_date":"1983-02-01","ids":{"openalex":"https://openalex.org/W2029007309","doi":"https://doi.org/10.1021/ci00037a008","mag":"2029007309"},"language":"en","primary_location":{"id":"doi:10.1021/ci00037a008","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci00037a008","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/A5042571649","display_name":"Andrea L. Fella","orcid":null},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"Andrea L. Fella","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5109935277","display_name":"James G. Nourse","orcid":null},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"James G. Nourse","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"last","author":{"id":"https://openalex.org/A5111785962","display_name":"Dennis H. Smith","orcid":null},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Dennis H. Smith","raw_affiliation_strings":[],"affiliations":[]}],"institutions":[],"countries_distinct_count":0,"institutions_distinct_count":3,"corresponding_author_ids":["https://openalex.org/A5042571649"],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":4,"citation_normalized_percentile":{"value":0.24645749,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"23","issue":"1","first_page":"43","last_page":"47"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10260","display_name":"Software Engineering Research","score":0.8776000142097473,"subfield":{"id":"https://openalex.org/subfields/1710","display_name":"Information Systems"},"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/T10260","display_name":"Software Engineering Research","score":0.8776000142097473,"subfield":{"id":"https://openalex.org/subfields/1710","display_name":"Information Systems"},"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/T10404","display_name":"Enzyme Catalysis and Immobilization","score":0.8601999878883362,"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/T11407","display_name":"Innovative Microfluidic and Catalytic Techniques Innovation","score":0.8263999819755554,"subfield":{"id":"https://openalex.org/subfields/2204","display_name":"Biomedical Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/citation","display_name":"Citation","score":0.7817479372024536},{"id":"https://openalex.org/keywords/icon","display_name":"Icon","score":0.7091739177703857},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.6852188110351562},{"id":"https://openalex.org/keywords/altmetrics","display_name":"Altmetrics","score":0.5864037275314331},{"id":"https://openalex.org/keywords/reuse","display_name":"Reuse","score":0.5286712646484375},{"id":"https://openalex.org/keywords/information-retrieval","display_name":"Information retrieval","score":0.4515570104122162},{"id":"https://openalex.org/keywords/social-media","display_name":"Social media","score":0.44064250588417053},{"id":"https://openalex.org/keywords/world-wide-web","display_name":"World Wide Web","score":0.346014142036438},{"id":"https://openalex.org/keywords/programming-language","display_name":"Programming language","score":0.07472479343414307}],"concepts":[{"id":"https://openalex.org/C2778805511","wikidata":"https://www.wikidata.org/wiki/Q1713","display_name":"Citation","level":2,"score":0.7817479372024536},{"id":"https://openalex.org/C2778447006","wikidata":"https://www.wikidata.org/wiki/Q1156474","display_name":"Icon","level":2,"score":0.7091739177703857},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.6852188110351562},{"id":"https://openalex.org/C2778407487","wikidata":"https://www.wikidata.org/wiki/Q14565201","display_name":"Altmetrics","level":2,"score":0.5864037275314331},{"id":"https://openalex.org/C206588197","wikidata":"https://www.wikidata.org/wiki/Q846574","display_name":"Reuse","level":2,"score":0.5286712646484375},{"id":"https://openalex.org/C23123220","wikidata":"https://www.wikidata.org/wiki/Q816826","display_name":"Information retrieval","level":1,"score":0.4515570104122162},{"id":"https://openalex.org/C518677369","wikidata":"https://www.wikidata.org/wiki/Q202833","display_name":"Social media","level":2,"score":0.44064250588417053},{"id":"https://openalex.org/C136764020","wikidata":"https://www.wikidata.org/wiki/Q466","display_name":"World Wide Web","level":1,"score":0.346014142036438},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.07472479343414307},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.0},{"id":"https://openalex.org/C18903297","wikidata":"https://www.wikidata.org/wiki/Q7150","display_name":"Ecology","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1021/ci00037a008","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci00037a008","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":[{"id":"https://openalex.org/F4320332161","display_name":"National Institutes of Health","ror":"https://ror.org/01cwqze88"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":0,"referenced_works":[],"related_works":["https://openalex.org/W2748952813","https://openalex.org/W2618017038","https://openalex.org/W3175319091","https://openalex.org/W2166317738","https://openalex.org/W2073023209","https://openalex.org/W2808646405","https://openalex.org/W3150373829","https://openalex.org/W1990918794","https://openalex.org/W2795304587","https://openalex.org/W4384945517"],"abstract_inverted_index":{"ADVERTISEMENT":[0],"RETURN":[1],"TO":[2],"ISSUEPREVArticleNEXTConformation":[3],"specification":[4],"of":[5,55,90,116],"chemical":[6],"structures":[7],"in":[8],"computer":[9],"programsAndrea":[10],"L.":[11],"Fella,":[12],"James":[13],"G.":[14],"Nourse,":[15],"and":[16,65,70,99,143,160,176,178],"Dennis":[17],"H.":[18],"SmithCite":[19],"this:":[20],"J.":[21],"Chem.":[22],"Inf.":[23],"Comput.":[24],"Sci.":[25],"1983,":[26],"23,":[27],"1,":[28,32],"43\u201347Publication":[29],"Date":[30],"(Print):February":[31],"1983Publication":[33],"History":[34],"Published":[35],"online1":[36],"May":[37],"2002Published":[38],"inissue":[39],"1":[40],"February":[41],"1983https://pubs.acs.org/doi/10.1021/ci00037a008https://doi.org/10.1021/ci00037a008research-articleACS":[42],"PublicationsRequest":[43],"reuse":[44],"permissionsArticle":[45],"Views21Altmetric-Citations3LEARN":[46],"ABOUT":[47],"THESE":[48],"METRICSArticle":[49],"Views":[50],"are":[51,74,87],"the":[52,83,88,117,128,141,144,149,156,162],"COUNTER-compliant":[53],"sum":[54],"full":[56],"text":[57],"article":[58,122],"downloads":[59],"since":[60],"November":[61],"2008":[62],"(both":[63],"PDF":[64],"HTML)":[66],"across":[67],"all":[68],"institutions":[69],"individuals.":[71],"These":[72],"metrics":[73],"regularly":[75],"updated":[76,100],"to":[77,82],"reflect":[78],"usage":[79],"leading":[80],"up":[81],"last":[84],"few":[85],"days.Citations":[86],"number":[89],"other":[91],"articles":[92],"citing":[93],"this":[94],"article,":[95],"calculated":[96],"by":[97],"Crossref":[98,106],"daily.":[101],"Find":[102,152],"more":[103,153],"information":[104,154],"about":[105,140],"citation":[107],"counts.The":[108],"Altmetric":[109,157],"Attention":[110,158],"Score":[111,159],"is":[112,164],"a":[113,120,133],"quantitative":[114],"measure":[115],"attention":[118],"that":[119],"research":[121],"has":[123],"received":[124],"online.":[125],"Clicking":[126],"on":[127,155],"donut":[129],"icon":[130],"will":[131],"load":[132],"page":[134],"at":[135],"altmetric.com":[136],"with":[137,172],"additional":[138],"details":[139],"score":[142,163],"social":[145],"media":[146],"presence":[147],"for":[148],"given":[150],"article.":[151],"how":[161],"calculated.":[165],"Share":[166,181],"Add":[167],"toView":[168],"InAdd":[169],"Full":[170],"Text":[171],"ReferenceAdd":[173],"Description":[174],"ExportRISCitationCitation":[175],"abstractCitation":[177],"referencesMore":[179],"Options":[180],"onFacebookTwitterWechatLinked":[182],"InRedditEmail":[183],"Other":[184],"access":[185],"options":[186],"Get":[187],"e-Alerts":[188]},"counts_by_year":[],"updated_date":"2025-11-06T03:46:38.306776","created_date":"2025-10-10T00:00:00"}
