{"id":"https://openalex.org/W2048558387","doi":"https://doi.org/10.1021/ci960467m","title":"Reaction Databases and Synthesis PlanningCombined Application and Synergetic Effects","display_name":"Reaction Databases and Synthesis PlanningCombined Application and Synergetic Effects","publication_year":1997,"publication_date":"1997-01-01","ids":{"openalex":"https://openalex.org/W2048558387","doi":"https://doi.org/10.1021/ci960467m","mag":"2048558387"},"language":"en","primary_location":{"id":"doi:10.1021/ci960467m","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci960467m","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/A5050161570","display_name":"Rainer Moll","orcid":null},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"Rainer Moll","raw_affiliation_strings":["CASAF Gesellschaft f\u00fcr Computerchemie mbH, Beuchaer Strasse 3, D-04318 Leipzig, Germany"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"CASAF Gesellschaft f\u00fcr Computerchemie mbH, Beuchaer Strasse 3, D-04318 Leipzig, Germany","institution_ids":[]}]}],"institutions":[],"countries_distinct_count":0,"institutions_distinct_count":0,"corresponding_author_ids":["https://openalex.org/A5050161570"],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":0.4122,"has_fulltext":false,"cited_by_count":3,"citation_normalized_percentile":{"value":0.66863989,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"37","issue":"1","first_page":"131","last_page":"133"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T12327","display_name":"Various Chemistry Research Topics","score":0.9643999934196472,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T12327","display_name":"Various Chemistry Research Topics","score":0.9643999934196472,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9613000154495239,"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/T11948","display_name":"Machine Learning in Materials Science","score":0.9567000269889832,"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/computer-science","display_name":"Computer science","score":0.6252785921096802},{"id":"https://openalex.org/keywords/suspect","display_name":"Suspect","score":0.5746532678604126},{"id":"https://openalex.org/keywords/process","display_name":"Process (computing)","score":0.5382864475250244},{"id":"https://openalex.org/keywords/database","display_name":"Database","score":0.532432496547699},{"id":"https://openalex.org/keywords/psychology","display_name":"Psychology","score":0.08891838788986206},{"id":"https://openalex.org/keywords/programming-language","display_name":"Programming language","score":0.08064520359039307}],"concepts":[{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.6252785921096802},{"id":"https://openalex.org/C2778223634","wikidata":"https://www.wikidata.org/wiki/Q224952","display_name":"Suspect","level":2,"score":0.5746532678604126},{"id":"https://openalex.org/C98045186","wikidata":"https://www.wikidata.org/wiki/Q205663","display_name":"Process (computing)","level":2,"score":0.5382864475250244},{"id":"https://openalex.org/C77088390","wikidata":"https://www.wikidata.org/wiki/Q8513","display_name":"Database","level":1,"score":0.532432496547699},{"id":"https://openalex.org/C15744967","wikidata":"https://www.wikidata.org/wiki/Q9418","display_name":"Psychology","level":0,"score":0.08891838788986206},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.08064520359039307},{"id":"https://openalex.org/C73484699","wikidata":"https://www.wikidata.org/wiki/Q161733","display_name":"Criminology","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1021/ci960467m","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci960467m","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":10,"referenced_works":["https://openalex.org/W1971521490","https://openalex.org/W1983806245","https://openalex.org/W1985538262","https://openalex.org/W2085498594","https://openalex.org/W2105966118","https://openalex.org/W2146294909","https://openalex.org/W2942742212","https://openalex.org/W2950644019","https://openalex.org/W2952421079","https://openalex.org/W4205245876"],"related_works":["https://openalex.org/W4391375266","https://openalex.org/W2748952813","https://openalex.org/W3197016913","https://openalex.org/W2389153751","https://openalex.org/W4386728183","https://openalex.org/W2185015567","https://openalex.org/W2394191954","https://openalex.org/W2113933481","https://openalex.org/W4292622136","https://openalex.org/W2559305818"],"abstract_inverted_index":{"Reaction":[0],"databases":[1,66],"are":[2],"recognized":[3],"as":[4,36,51],"very":[5],"useful":[6],"tools":[7,91],"for":[8,27,79],"the":[9,19,41,54,80],"organic":[10],"chemist,":[11],"whereas":[12],"computer-aided":[13],"synthesis":[14,33,74,84],"planning":[15,75],"does":[16],"not":[17],"play":[18],"same":[20],"role":[21],"up":[22],"to":[23],"now.":[24],"The":[25],"reason":[26],"this,":[28],"among":[29],"others,":[30],"is":[31,34,48],"that":[32,61],"seen":[35],"a":[37],"creative":[38],"process,":[39],"and":[40,70],"assistance":[42],"of":[43,82,89],"it":[44,57],"by":[45,72,86,95],"computer":[46],"programs":[47],"still":[49],"considered":[50],"suspect.":[52],"On":[53],"other":[55],"hand,":[56],"could":[58],"be":[59,68,93],"shown":[60,94],"information":[62],"extracted":[63],"from":[64],"reaction":[65],"can":[67],"improved":[69],"completed":[71],"using":[73],"programs.":[76],"Interesting":[77],"possibilities":[78],"development":[81],"new":[83],"schemes":[85],"combined":[87],"utilization":[88],"both":[90],"will":[92],"some":[96],"examples.":[97]},"counts_by_year":[],"updated_date":"2025-11-06T03:46:38.306776","created_date":"2025-10-10T00:00:00"}
