乐胖代购免代理版

{"id":"https://openalex.org/W2006489199","doi":"https://doi.org/10.1021/ci0101051","title":"Application of Quantitative Artificial Neural Network Analysis to 2D NMR Spectra of Hydrocarbon Mixtures","display_name":"Application of Quantitative Artificial Neural Network Analysis to 2D NMR Spectra of Hydrocarbon Mixtures","publication_year":2002,"publication_date":"2002-10-18","ids":{"openalex":"https://openalex.org/W2006489199","doi":"https://doi.org/10.1021/ci0101051","mag":"2006489199","pmid":"https://pubmed.ncbi.nlm.nih.gov/12444730"},"language":"en","primary_location":{"is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci0101051","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":null,"is_accepted":false,"is_published":false},"type":"article","type_crossref":"journal-article","indexed_in":["crossref","pubmed"],"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/A5091721688","display_name":"T. V\u00e4\u00e4n\u00e4nen","orcid":null},"institutions":[{"id":"https://openalex.org/I2801249761","display_name":"Fortum (Finland)","ror":"https://ror.org/03nx8tr59","country_code":"FI","type":"company","lineage":["https://openalex.org/I2801249761"]},{"id":"https://openalex.org/I63548447","display_name":"Lappeenranta-Lahti University of Technology","ror":"https://ror.org/0208vgz68","country_code":"FI","type":"education","lineage":["https://openalex.org/I63548447"]},{"id":"https://openalex.org/I98381234","display_name":"University of Oulu","ror":"https://ror.org/03yj89h83","country_code":"FI","type":"education","lineage":["https://openalex.org/I98381234"]}],"countries":["FI"],"is_corresponding":false,"raw_author_name":"Taito V\u00e4\u00e4n\u00e4nen","raw_affiliation_strings":["Fortum Oil and Gas Oy, Technology Centre, P.O. Box 310, FIN-06101 Porvoo, Finland, Department of Chemistry, University of Oulu, P.O. Box 3000, FIN-90014 Oulu, Finland, Pehr Brahe Software Laboratory, University of Oulu, Rantakatu 8, FIN-92100 Raahe, Finland, and Lappeenranta University of Technology, P.O. Box 20, FIN-53851 Lappeenranta, Finland"],"affiliations":[{"raw_affiliation_string":"Fortum Oil and Gas Oy, Technology Centre, P.O. Box 310, FIN-06101 Porvoo, Finland, Department of Chemistry, University of Oulu, P.O. Box 3000, FIN-90014 Oulu, Finland, Pehr Brahe Software Laboratory, University of Oulu, Rantakatu 8, FIN-92100 Raahe, Finland, and Lappeenranta University of Technology, P.O. Box 20, FIN-53851 Lappeenranta, Finland","institution_ids":["https://openalex.org/I2801249761","https://openalex.org/I63548447","https://openalex.org/I98381234"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5084785288","display_name":"Harri Koskela","orcid":"https://orcid.org/0000-0002-7552-3813"},"institutions":[{"id":"https://openalex.org/I63548447","display_name":"Lappeenranta-Lahti University of Technology","ror":"https://ror.org/0208vgz68","country_code":"FI","type":"education","lineage":["https://openalex.org/I63548447"]},{"id":"https://openalex.org/I98381234","display_name":"University of Oulu","ror":"https://ror.org/03yj89h83","country_code":"FI","type":"education","lineage":["https://openalex.org/I98381234"]},{"id":"https://openalex.org/I2801249761","display_name":"Fortum (Finland)","ror":"https://ror.org/03nx8tr59","country_code":"FI","type":"company","lineage":["https://openalex.org/I2801249761"]}],"countries":["FI"],"is_corresponding":false,"raw_author_name":"Harri Koskela","raw_affiliation_strings":["Fortum Oil and Gas Oy, Technology Centre, P.O. Box 310, FIN-06101 Porvoo, Finland, Department of Chemistry, University of Oulu, P.O. Box 3000, FIN-90014 Oulu, Finland, Pehr Brahe Software Laboratory, University of Oulu, Rantakatu 8, FIN-92100 Raahe, Finland, and Lappeenranta University of Technology, P.O. Box 20, FIN-53851 Lappeenranta, Finland"],"affiliations":[{"raw_affiliation_string":"Fortum Oil and Gas Oy, Technology Centre, P.O. Box 310, FIN-06101 Porvoo, Finland, Department of Chemistry, University of Oulu, P.O. Box 3000, FIN-90014 Oulu, Finland, Pehr Brahe Software Laboratory, University of Oulu, Rantakatu 8, FIN-92100 Raahe, Finland, and Lappeenranta University of Technology, P.O. Box 20, FIN-53851 Lappeenranta, Finland","institution_ids":["https://openalex.org/I63548447","https://openalex.org/I98381234","https://openalex.org/I2801249761"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5108351119","display_name":"Yrj\u00f6 Hiltunen","orcid":null},"institutions":[{"id":"https://openalex.org/I63548447","display_name":"Lappeenranta-Lahti University of Technology","ror":"https://ror.org/0208vgz68","country_code":"FI","type":"education","lineage":["https://openalex.org/I63548447"]},{"id":"https://openalex.org/I98381234","display_name":"University of Oulu","ror":"https://ror.org/03yj89h83","country_code":"FI","type":"education","lineage":["https://openalex.org/I98381234"]},{"id":"https://openalex.org/I2801249761","display_name":"Fortum (Finland)","ror":"https://ror.org/03nx8tr59","country_code":"FI","type":"company","lineage":["https://openalex.org/I2801249761"]}],"countries":["FI"],"is_corresponding":false,"raw_author_name":"Yrj\u00f6 Hiltunen","raw_affiliation_strings":["Fortum Oil and Gas Oy, Technology Centre, P.O. Box 310, FIN-06101 Porvoo, Finland, Department of Chemistry, University of Oulu, P.O. Box 3000, FIN-90014 Oulu, Finland, Pehr Brahe Software Laboratory, University of Oulu, Rantakatu 8, FIN-92100 Raahe, Finland, and Lappeenranta University of Technology, P.O. Box 20, FIN-53851 Lappeenranta, Finland"],"affiliations":[{"raw_affiliation_string":"Fortum Oil and Gas Oy, Technology Centre, P.O. Box 310, FIN-06101 Porvoo, Finland, Department of Chemistry, University of Oulu, P.O. Box 3000, FIN-90014 Oulu, Finland, Pehr Brahe Software Laboratory, University of Oulu, Rantakatu 8, FIN-92100 Raahe, Finland, and Lappeenranta University of Technology, P.O. Box 20, FIN-53851 Lappeenranta, Finland","institution_ids":["https://openalex.org/I63548447","https://openalex.org/I98381234","https://openalex.org/I2801249761"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5078073418","display_name":"Mika Ala\u2010Korpela","orcid":"https://orcid.org/0000-0001-5905-1206"},"institutions":[{"id":"https://openalex.org/I63548447","display_name":"Lappeenranta-Lahti University of Technology","ror":"https://ror.org/0208vgz68","country_code":"FI","type":"education","lineage":["https://openalex.org/I63548447"]},{"id":"https://openalex.org/I98381234","display_name":"University of Oulu","ror":"https://ror.org/03yj89h83","country_code":"FI","type":"education","lineage":["https://openalex.org/I98381234"]},{"id":"https://openalex.org/I2801249761","display_name":"Fortum (Finland)","ror":"https://ror.org/03nx8tr59","country_code":"FI","type":"company","lineage":["https://openalex.org/I2801249761"]}],"countries":["FI"],"is_corresponding":false,"raw_author_name":"Mika Ala-Korpela","raw_affiliation_strings":["Fortum Oil and Gas Oy, Technology Centre, P.O. Box 310, FIN-06101 Porvoo, Finland, Department of Chemistry, University of Oulu, P.O. Box 3000, FIN-90014 Oulu, Finland, Pehr Brahe Software Laboratory, University of Oulu, Rantakatu 8, FIN-92100 Raahe, Finland, and Lappeenranta University of Technology, P.O. Box 20, FIN-53851 Lappeenranta, Finland"],"affiliations":[{"raw_affiliation_string":"Fortum Oil and Gas Oy, Technology Centre, P.O. Box 310, FIN-06101 Porvoo, Finland, Department of Chemistry, University of Oulu, P.O. Box 3000, FIN-90014 Oulu, Finland, Pehr Brahe Software Laboratory, University of Oulu, Rantakatu 8, FIN-92100 Raahe, Finland, and Lappeenranta University of Technology, P.O. Box 20, FIN-53851 Lappeenranta, Finland","institution_ids":["https://openalex.org/I63548447","https://openalex.org/I98381234","https://openalex.org/I2801249761"]}]}],"institution_assertions":[],"countries_distinct_count":1,"institutions_distinct_count":3,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":0.986,"has_fulltext":true,"fulltext_origin":"ngrams","cited_by_count":20,"citation_normalized_percentile":{"value":0.714505,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":85,"max":86},"biblio":{"volume":"42","issue":"6","first_page":"1343","last_page":"1346"},"is_retracted":false,"is_paratext":false,"primary_topic":{"id":"https://openalex.org/T10640","display_name":"Spectroscopy and Chemometric Analyses","score":0.9981,"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"}},"topics":[{"id":"https://openalex.org/T10640","display_name":"Spectroscopy and Chemometric Analyses","score":0.9981,"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/T12603","display_name":"NMR spectroscopy and applications","score":0.9979,"subfield":{"id":"https://openalex.org/subfields/3106","display_name":"Nuclear and High Energy Physics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10836","display_name":"Metabolomics and Mass Spectrometry Studies","score":0.9908,"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/hydrocarbon-mixtures","display_name":"Hydrocarbon mixtures","score":0.5737892},{"id":"https://openalex.org/keywords/sample","display_name":"Sample (material)","score":0.46280307}],"concepts":[{"id":"https://openalex.org/C50644808","wikidata":"https://www.wikidata.org/wiki/Q192776","display_name":"Artificial neural network","level":2,"score":0.6294488},{"id":"https://openalex.org/C67787023","wikidata":"https://www.wikidata.org/wiki/Q6954755","display_name":"NMR spectra database","level":3,"score":0.60559565},{"id":"https://openalex.org/C2776692518","wikidata":"https://www.wikidata.org/wiki/Q16999976","display_name":"Hydrocarbon mixtures","level":3,"score":0.5737892},{"id":"https://openalex.org/C186060115","wikidata":"https://www.wikidata.org/wiki/Q30336093","display_name":"Biological system","level":1,"score":0.5626032},{"id":"https://openalex.org/C66974803","wikidata":"https://www.wikidata.org/wiki/Q10359898","display_name":"Nuclear magnetic resonance spectroscopy","level":2,"score":0.53320473},{"id":"https://openalex.org/C4839761","wikidata":"https://www.wikidata.org/wiki/Q212111","display_name":"Spectral line","level":2,"score":0.5164307},{"id":"https://openalex.org/C198531522","wikidata":"https://www.wikidata.org/wiki/Q485146","display_name":"Sample (material)","level":2,"score":0.46280307},{"id":"https://openalex.org/C177264268","wikidata":"https://www.wikidata.org/wiki/Q1514741","display_name":"Set (abstract data type)","level":2,"score":0.44758242},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.44742328},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.41739672},{"id":"https://openalex.org/C32891209","wikidata":"https://www.wikidata.org/wiki/Q483666","display_name":"Spectroscopy","level":2,"score":0.41554028},{"id":"https://openalex.org/C2777207669","wikidata":"https://www.wikidata.org/wiki/Q43648","display_name":"Hydrocarbon","level":2,"score":0.4092328},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.36930662},{"id":"https://openalex.org/C183696295","wikidata":"https://www.wikidata.org/wiki/Q2487696","display_name":"Biochemical engineering","level":1,"score":0.35877332},{"id":"https://openalex.org/C153180895","wikidata":"https://www.wikidata.org/wiki/Q7148389","display_name":"Pattern recognition (psychology)","level":2,"score":0.33254448},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.15475744},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.15449616},{"id":"https://openalex.org/C127413603","wikidata":"https://www.wikidata.org/wiki/Q11023","display_name":"Engineering","level":0,"score":0.13323504},{"id":"https://openalex.org/C43617362","wikidata":"https://www.wikidata.org/wiki/Q170050","display_name":"Chromatography","level":1,"score":0.10885176},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.0},{"id":"https://openalex.org/C1276947","wikidata":"https://www.wikidata.org/wiki/Q333","display_name":"Astronomy","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},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.0}],"mesh":[],"locations_count":2,"locations":[{"is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci0101051","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":null,"is_accepted":false,"is_published":false},{"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/12444730","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":["National Institutes of Health"],"type":"repository"},"license":null,"license_id":null,"version":null,"is_accepted":false,"is_published":false}],"best_oa_location":null,"sustainable_development_goals":[{"id":"https://metadata.un.org/sdg/9","display_name":"Industry, innovation and infrastructure","score":0.43}],"grants":[],"datasets":[],"versions":[],"referenced_works_count":17,"referenced_works":["https://openalex.org/W1584929418","https://openalex.org/W1965557938","https://openalex.org/W1973949272","https://openalex.org/W1978405512","https://openalex.org/W1981396806","https://openalex.org/W1996721718","https://openalex.org/W2008623235","https://openalex.org/W2032935241","https://openalex.org/W2033937477","https://openalex.org/W2034363110","https://openalex.org/W2046325363","https://openalex.org/W2069734146","https://openalex.org/W2077314690","https://openalex.org/W2095001425","https://openalex.org/W2132447042","https://openalex.org/W2616311551","https://openalex.org/W4249028950"],"related_works":["https://openalex.org/W303355557","https://openalex.org/W2554390156","https://openalex.org/W2332645719","https://openalex.org/W2072635906","https://openalex.org/W2044036174","https://openalex.org/W2011539552","https://openalex.org/W1995591187","https://openalex.org/W1977184376","https://openalex.org/W1967601245","https://openalex.org/W1122128473"],"abstract_inverted_index":{"Understanding":[0],"relationships":[1,53,196],"between":[2,197],"the":[3,28,33,44,48,82,87,105,114,143,151,192,198,212],"structure":[4],"and":[5,10,56,59,68,139,194,201],"composition":[6,200],"of":[7,22,36,47,84,89,146,159,163,170,214],"molecular":[8,34,199],"mixtures":[9,39],"their":[11],"chemical":[12],"properties":[13,46],"is":[14,24,31,73,176,208],"a":[15,94,120,157,223],"main":[16],"industrial":[17],"aim.":[18],"One":[19],"central":[20],"field":[21],"research":[23],"oil":[25,49,164],"chemistry":[26],"where":[27],"key":[29],"question":[30],"how":[32],"characteristics":[35],"composite":[37,85],"hydrocarbon":[38],"can":[40,218],"be":[41,220],"associated":[42],"with":[43],"macroscopic":[45],"products.":[50],"Apparently":[51],"these":[52],"are":[54],"complex":[55,193],"often":[57],"nonlinear":[58,195],"therefore":[60],"call":[61],"for":[62,173],"advanced":[63],"spectroscopic":[64,229],"techniques.":[65],"An":[66],"informative":[67],"an":[69,187],"increasingly":[70],"used":[71],"approach":[72],"two-dimensional":[74],"nuclear":[75],"magnetic":[76],"resonance":[77],"(2D":[78],"NMR)":[79],"spectroscopy.":[80],"In":[81],"case":[83],"hydrocarbons":[86],"application":[88],"2D":[90,136,160,180],"NMR":[91,137,161,215],"methodologies":[92],"in":[93,102,135,156,179,222],"quantitative":[95,125,174],"manner":[96,224],"pose":[97],"many":[98,109],"technical":[99],"difficulties,":[100],"and,":[101,181],"any":[103],"case,":[104],"resulting":[106],"spectra":[107,138,162,216],"contain":[108],"overlapping":[110,133],"resonances":[111],"that":[112,168,183],"challenge":[113],"analytical":[115],"work.":[116],"Here,":[117],"we":[118],"present":[119],"general":[121],"methodology,":[122],"based":[123],"on":[124,150],"artificial":[126],"neural":[127],"network":[128],"(ANN)":[129],"analysis,":[130],"to":[131,140,190,211,226],"resolve":[132],"information":[134],"simultaneously":[141],"assess":[142,191],"relative":[144],"importance":[145],"multiple":[147],"spectral":[148],"variables":[149],"sample":[152,202],"properties.":[153,203],"The":[154,204],"results":[155],"set":[158],"samples":[165],"illustrate,":[166],"first,":[167],"use":[169],"ANN":[171,206],"analysis":[172,213],"purposes":[175],"feasible":[177],"also":[178,219],"second,":[182],"this":[184],"methodology":[185,207],"offers":[186],"intrinsic":[188],"opportunity":[189],"presented":[205],"not":[209],"limited":[210],"but":[217],"applied":[221],"similar":[225],"other":[227],"(multidimensional)":[228],"data.":[230]},"cited_by_api_url":"https://api.openalex.org/works?filter=cites:W2006489199","counts_by_year":[{"year":2023,"cited_by_count":1},{"year":2022,"cited_by_count":1},{"year":2021,"cited_by_count":1},{"year":2020,"cited_by_count":3},{"year":2014,"cited_by_count":2}],"updated_date":"2025-01-03T23:58:50.391275","created_date":"2016-06-24"}