{"id":"https://openalex.org/W1998392858","doi":"https://doi.org/10.1134/s0965544111040074","title":"Modeling the octane numbers of alkenes by the inverse function method","display_name":"Modeling the octane numbers of alkenes by the inverse function method","publication_year":2011,"publication_date":"2011-09-01","ids":{"openalex":"https://openalex.org/W1998392858","doi":"https://doi.org/10.1134/s0965544111040074","mag":"1998392858"},"language":"en","primary_location":{"id":"doi:10.1134/s0965544111040074","doi":"https://doi.org/10.1134/s0965544111040074","is_oa":false,"landing_page_url":"https://doi.org/10.1134/s0965544111040074","pdf_url":null,"source":{"id":"https://openalex.org/S181504447","display_name":"Petroleum Chemistry","issn_l":"0028-2421","issn":["0028-2421","0965-5441","1555-6239","3034-5626"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","norway-1","poland-40","russia-white-list-1","russia-white-list-2"],"host_organization":"https://openalex.org/P4310320267","host_organization_name":"Pleiades Publishing","host_organization_lineage":["https://openalex.org/P4310320267","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Pleiades Publishing","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Petroleum Chemistry","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"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/A5103423664","display_name":"A. N. Ryzhov","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I1313323035","display_name":"Russian Academy of Sciences","ror":"https://ror.org/05qrfxd25","country_code":"RU","type":"government","lineage":["https://openalex.org/I1313323035"]},{"id":"https://openalex.org/I4210088206","display_name":"N.D. Zelinsky Institute of Organic Chemistry","ror":"https://ror.org/007phxq15","country_code":"RU","type":"facility","lineage":["https://openalex.org/I1313323035","https://openalex.org/I4210088206","https://openalex.org/I4210145551"]}],"countries":["RU"],"is_corresponding":true,"raw_author_name":"A. N. Ryzhov","raw_affiliation_strings":["Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russia","Russian Academy of Sciences"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russia","institution_ids":["https://openalex.org/I1313323035","https://openalex.org/I4210088206"]},{"raw_affiliation_string":"Russian Academy of Sciences","institution_ids":["https://openalex.org/I1313323035"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5048967289","display_name":"Yu. A. Strizhakova","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I1313323035","display_name":"Russian Academy of Sciences","ror":"https://ror.org/05qrfxd25","country_code":"RU","type":"government","lineage":["https://openalex.org/I1313323035"]},{"id":"https://openalex.org/I4210088206","display_name":"N.D. Zelinsky Institute of Organic Chemistry","ror":"https://ror.org/007phxq15","country_code":"RU","type":"facility","lineage":["https://openalex.org/I1313323035","https://openalex.org/I4210088206","https://openalex.org/I4210145551"]}],"countries":["RU"],"is_corresponding":false,"raw_author_name":"Yu. A. Strizhakova","raw_affiliation_strings":["Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russia","Russian Academy of Sciences"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russia","institution_ids":["https://openalex.org/I1313323035","https://openalex.org/I4210088206"]},{"raw_affiliation_string":"Russian Academy of Sciences","institution_ids":["https://openalex.org/I1313323035"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5084632256","display_name":"Evgenii A. Smolenskii","orcid":"https://orcid.org/0000-0003-0401-8630","observed_orcids":["https://orcid.org/0000-0003-0401-8630"]},"institutions":[{"id":"https://openalex.org/I1313323035","display_name":"Russian Academy of Sciences","ror":"https://ror.org/05qrfxd25","country_code":"RU","type":"government","lineage":["https://openalex.org/I1313323035"]},{"id":"https://openalex.org/I4210088206","display_name":"N.D. Zelinsky Institute of Organic Chemistry","ror":"https://ror.org/007phxq15","country_code":"RU","type":"facility","lineage":["https://openalex.org/I1313323035","https://openalex.org/I4210088206","https://openalex.org/I4210145551"]}],"countries":["RU"],"is_corresponding":false,"raw_author_name":"E. A. Smolenskii","raw_affiliation_strings":["Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russia","Russian Academy of Sciences"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russia","institution_ids":["https://openalex.org/I1313323035","https://openalex.org/I4210088206"]},{"raw_affiliation_string":"Russian Academy of Sciences","institution_ids":["https://openalex.org/I1313323035"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5005937556","display_name":"\u0410. \u041b. \u041b\u0430\u043f\u0438\u0434\u0443\u0441","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I1313323035","display_name":"Russian Academy of Sciences","ror":"https://ror.org/05qrfxd25","country_code":"RU","type":"government","lineage":["https://openalex.org/I1313323035"]},{"id":"https://openalex.org/I4210088206","display_name":"N.D. Zelinsky Institute of Organic Chemistry","ror":"https://ror.org/007phxq15","country_code":"RU","type":"facility","lineage":["https://openalex.org/I1313323035","https://openalex.org/I4210088206","https://openalex.org/I4210145551"]}],"countries":["RU"],"is_corresponding":false,"raw_author_name":"A. L. Lapidus","raw_affiliation_strings":["Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russia","Russian Academy of Sciences"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russia","institution_ids":["https://openalex.org/I1313323035","https://openalex.org/I4210088206"]},{"raw_affiliation_string":"Russian Academy of Sciences","institution_ids":["https://openalex.org/I1313323035"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":2,"corresponding_author_ids":["https://openalex.org/A5103423664"],"corresponding_institution_ids":["https://openalex.org/I1313323035","https://openalex.org/I4210088206"],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":9,"citation_normalized_percentile":{"value":0.0,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":88,"max":96},"biblio":{"volume":"51","issue":"5","first_page":"354","last_page":"362"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11476","display_name":"Graph theory and applications","score":0.9746000170707703,"subfield":{"id":"https://openalex.org/subfields/2607","display_name":"Discrete Mathematics and Combinatorics"},"field":{"id":"https://openalex.org/fields/26","display_name":"Mathematics"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T11476","display_name":"Graph theory and applications","score":0.9746000170707703,"subfield":{"id":"https://openalex.org/subfields/2607","display_name":"Discrete Mathematics and Combinatorics"},"field":{"id":"https://openalex.org/fields/26","display_name":"Mathematics"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11630","display_name":"Petroleum Processing and Analysis","score":0.011800000444054604,"subfield":{"id":"https://openalex.org/subfields/1602","display_name":"Analytical 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/T12852","display_name":"Chemical Thermodynamics and Molecular Structure","score":0.0026000000070780516,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/octane-number","display_name":"octane number","score":0.843999981880188},{"id":"https://openalex.org/keywords/alkenes","display_name":"alkenes","score":0.9980000257492065},{"id":"https://openalex.org/keywords/quantitative-structure-property-relationship","display_name":"QSPR","score":0.8309999704360962},{"id":"https://openalex.org/keywords/octane-number-prediction","display_name":"octane number prediction","score":0.7400000095367432},{"id":"https://openalex.org/keywords/n-alkanes","display_name":"n-alkanes","score":0.671999990940094},{"id":"https://openalex.org/keywords/carbon-number-dependence","display_name":"carbon number dependence","score":0.5460000038146973}],"concepts":[{"id":"https://openalex.org/C2776624427","wikidata":"https://www.wikidata.org/wiki/Q150681","display_name":"Octane","level":2,"score":0.8460410833358765},{"id":"https://openalex.org/C207467116","wikidata":"https://www.wikidata.org/wiki/Q4385666","display_name":"Inverse","level":2,"score":0.6607925891876221},{"id":"https://openalex.org/C14036430","wikidata":"https://www.wikidata.org/wiki/Q3736076","display_name":"Function (biology)","level":2,"score":0.5963773727416992},{"id":"https://openalex.org/C163721339","wikidata":"https://www.wikidata.org/wiki/Q193423","display_name":"Octane rating","level":3,"score":0.5874788761138916},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.42561644315719604},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.424141526222229},{"id":"https://openalex.org/C28826006","wikidata":"https://www.wikidata.org/wiki/Q33521","display_name":"Applied mathematics","level":1,"score":0.4096531867980957},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.3713921904563904},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.16752207279205322},{"id":"https://openalex.org/C2524010","wikidata":"https://www.wikidata.org/wiki/Q8087","display_name":"Geometry","level":1,"score":0.08188262581825256},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.0},{"id":"https://openalex.org/C105923489","wikidata":"https://www.wikidata.org/wiki/Q133235","display_name":"Combustion","level":2,"score":0.0},{"id":"https://openalex.org/C78458016","wikidata":"https://www.wikidata.org/wiki/Q840400","display_name":"Evolutionary biology","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1134/s0965544111040074","doi":"https://doi.org/10.1134/s0965544111040074","is_oa":false,"landing_page_url":"https://doi.org/10.1134/s0965544111040074","pdf_url":null,"source":{"id":"https://openalex.org/S181504447","display_name":"Petroleum Chemistry","issn_l":"0028-2421","issn":["0028-2421","0965-5441","1555-6239","3034-5626"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","norway-1","poland-40","russia-white-list-1","russia-white-list-2"],"host_organization":"https://openalex.org/P4310320267","host_organization_name":"Pleiades Publishing","host_organization_lineage":["https://openalex.org/P4310320267","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Pleiades Publishing","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Petroleum Chemistry","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":10,"referenced_works":["https://openalex.org/W2000462523","https://openalex.org/W2007667733","https://openalex.org/W2021229217","https://openalex.org/W2046283501","https://openalex.org/W2049160711","https://openalex.org/W2063292910","https://openalex.org/W2184257197","https://openalex.org/W2312328781","https://openalex.org/W2318794083","https://openalex.org/W6611736283"],"related_works":["https://openalex.org/W2085502046","https://openalex.org/W3188168311","https://openalex.org/W4248391014","https://openalex.org/W3135961402","https://openalex.org/W2356535079","https://openalex.org/W2016468336","https://openalex.org/W4323785495","https://openalex.org/W1984965734","https://openalex.org/W3134647056","https://openalex.org/W2390506414"],"abstract_inverted_index":{"On":[0],"the":[1,4,12,18,29,38,47,57],"basis":[2],"of":[3,31,41,49,65,73,76],"octane-number":[5],"topological":[6,51],"equivalents":[7],"(TEs)":[8],"constructed":[9],"earlier":[10],"by":[11,21,69],"inverse":[13],"function":[14],"method,":[15],"related":[16],"to":[17],"octane":[19,39,81],"numbers":[20,40,82],"a":[22,70],"biunique":[23],"function,":[24],"and":[25],"linearly":[26],"dependent":[27],"on":[28],"number":[30],"carbon":[32],"atoms":[33],"n":[34,36],"for":[35,85],"-alkanes,":[37],"alkenes":[42,87],"have":[43,89],"been":[44,91],"simulated":[45],"with":[46],"use":[48],"optimal":[50],"indices.":[52],"The":[53,80],"models":[54],"obtained":[55],"suggest":[56],"maximum":[58],"attainable":[59],"(within":[60],"linear":[61],"QSPR":[62],"approaches)":[63],"accuracy":[64],"calculation,":[66],"which":[67],"exceeds":[68],"few":[71],"orders":[72],"magnitude":[74],"that":[75,88],"previously":[77],"known":[78],"procedures.":[79],"are":[83],"predicted":[84],"68":[86],"not":[90],"characterized":[92],"experimentally.":[93]},"counts_by_year":[{"year":2024,"cited_by_count":1},{"year":2022,"cited_by_count":2},{"year":2020,"cited_by_count":1},{"year":2019,"cited_by_count":1},{"year":2018,"cited_by_count":2},{"year":2016,"cited_by_count":2}],"updated_date":"2026-11-07T11:25:07.637180","created_date":"2016-06-24T00:00:00"}
