{"id":"https://openalex.org/W3040201078","doi":"https://doi.org/10.1021/acs.analchem.9b05718","title":"Resolution of Isomeric Mixtures in Ion Mobility Using a Combined Demultiplexing and Peak Deconvolution Technique","display_name":"Resolution of Isomeric Mixtures in Ion Mobility Using a Combined Demultiplexing and Peak Deconvolution Technique","publication_year":2020,"publication_date":"2020-07-06","ids":{"openalex":"https://openalex.org/W3040201078","doi":"https://doi.org/10.1021/acs.analchem.9b05718","mag":"3040201078","pmid":"https://pubmed.ncbi.nlm.nih.gov/32628451"},"language":"en","primary_location":{"id":"doi:10.1021/acs.analchem.9b05718","doi":"https://doi.org/10.1021/acs.analchem.9b05718","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.analchem.9b05718","pdf_url":null,"source":{"id":"https://openalex.org/S191963794","display_name":"Analytical Chemistry","issn_l":"0003-2700","issn":["0003-2700","1520-6882"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-class-a","anvur-scientific","cwts-core","dongbi-a","doyens","jufo-3","ki-jl-2","medline","norway-2","poland-140","russia-white-list-1","vabb-shw"],"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":"Analytical Chemistry","raw_type":"journal-article"},"volume":null,"type":"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/A5005697074","display_name":"Jody C. May","orcid":"https://orcid.org/0000-0003-4871-5024","observed_orcids":["https://orcid.org/0000-0003-4871-5024"]},"institutions":[{"id":"https://openalex.org/I200719446","display_name":"Vanderbilt University","ror":"https://ror.org/02vm5rt34","country_code":"US","type":"education","lineage":["https://openalex.org/I200719446"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Jody C. May","raw_affiliation_strings":["Vanderbilt University , , , ,","Department of Chemistry, Vanderbilt University, Nashville, Tennessee 37235, United States"],"raw_orcid":"https://orcid.org/0000-0003-4871-5024","affiliations":[{"raw_affiliation_string":"Vanderbilt University , , , ,","institution_ids":["https://openalex.org/I200719446"]},{"raw_affiliation_string":"Department of Chemistry, Vanderbilt University, Nashville, Tennessee 37235, United States","institution_ids":["https://openalex.org/I200719446"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5066508058","display_name":"Richard Knochenmuss","orcid":"https://orcid.org/0000-0002-9701-2045","observed_orcids":["https://orcid.org/0000-0002-9701-2045"]},"institutions":[{"id":"https://openalex.org/I4405255958","display_name":"Laboratoire d'Informatique en Calcul Intensif et Image pour la Simulation","ror":"https://ror.org/03m4qdj85","country_code":"FR","type":"education","lineage":["https://openalex.org/I4405255958","https://openalex.org/I96226040"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"Richard Knochenmuss","raw_affiliation_strings":["RKResearch GmbH , ,","RKResearch GmbH, 3662 Seftigen, Switzerland"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"RKResearch GmbH , ,","institution_ids":[]},{"raw_affiliation_string":"RKResearch GmbH, 3662 Seftigen, Switzerland","institution_ids":["https://openalex.org/I4405255958"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5043909271","display_name":"John C. Fjeldsted","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I138285227","display_name":"Agilent Technologies (United States)","ror":"https://ror.org/02tryst02","country_code":"US","type":"company","lineage":["https://openalex.org/I138285227"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"John C. Fjeldsted","raw_affiliation_strings":["Agilent Technologies , , ,","Agilent Technologies, Santa Clara, California 95051, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Agilent Technologies , , ,","institution_ids":[]},{"raw_affiliation_string":"Agilent Technologies, Santa Clara, California 95051, United States","institution_ids":["https://openalex.org/I138285227"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5026144955","display_name":"JOHN A. JUN. MCLEAN","orcid":"https://orcid.org/0000-0001-8918-6419","observed_orcids":["https://orcid.org/0000-0001-8918-6419"]},"institutions":[{"id":"https://openalex.org/I200719446","display_name":"Vanderbilt University","ror":"https://ror.org/02vm5rt34","country_code":"US","type":"education","lineage":["https://openalex.org/I200719446"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"John A. McLean","raw_affiliation_strings":["Vanderbilt University , , , ,","Department of Chemistry, Vanderbilt University, Nashville, Tennessee 37235, United States"],"raw_orcid":"https://orcid.org/0000-0001-8918-6419","affiliations":[{"raw_affiliation_string":"Vanderbilt University , , , ,","institution_ids":["https://openalex.org/I200719446"]},{"raw_affiliation_string":"Department of Chemistry, Vanderbilt University, Nashville, Tennessee 37235, United States","institution_ids":["https://openalex.org/I200719446"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":3,"corresponding_author_ids":["https://openalex.org/A5026144955"],"corresponding_institution_ids":["https://openalex.org/I200719446"],"apc_list":{"value":5000,"currency":"USD","value_usd":5000},"apc_paid":null,"fwci":6.2524,"has_fulltext":false,"cited_by_count":109,"citation_normalized_percentile":{"value":0.98537267,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":88,"max":100},"biblio":{"volume":"92","issue":"14","first_page":"9482","last_page":"9492"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10683","display_name":"Mass Spectrometry Techniques and Applications","score":0.9994999766349792,"subfield":{"id":"https://openalex.org/subfields/1607","display_name":"Spectroscopy"},"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/T10683","display_name":"Mass Spectrometry Techniques and Applications","score":0.9994999766349792,"subfield":{"id":"https://openalex.org/subfields/1607","display_name":"Spectroscopy"},"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/T10836","display_name":"Metabolomics and Mass Spectrometry Studies","score":9.999999747378752e-05,"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/T10519","display_name":"Advanced Proteomics Techniques and Applications","score":0.0,"subfield":{"id":"https://openalex.org/subfields/1607","display_name":"Spectroscopy"},"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/ion-mobility-mass-spectrometry","display_name":"ion mobility mass spectrometry","score":0.8999999761581421},{"id":"https://openalex.org/keywords/isomer-resolution","display_name":"isomer resolution","score":0.6119999885559082},{"id":"https://openalex.org/keywords/demultiplexing","display_name":"demultiplexing","score":0.7990000247955322},{"id":"https://openalex.org/keywords/peak-deconvolution","display_name":"peak deconvolution","score":0.9900000095367432},{"id":"https://openalex.org/keywords/drift-tube-ion-mobility","display_name":"drift tube ion mobility","score":0.7110000252723694},{"id":"https://openalex.org/keywords/collision-cross-sections","display_name":"collision cross sections","score":0.5370000004768372},{"id":"https://openalex.org/keywords/lipids","display_name":"lipids","score":0.621999979019165},{"id":"https://openalex.org/keywords/carbohydrates","display_name":"carbohydrates","score":0.9869999885559082},{"id":"https://openalex.org/keywords/resolving-power","display_name":"resolving power","score":0.7770000100135803}],"concepts":[{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.8813859820365906},{"id":"https://openalex.org/C174576160","wikidata":"https://www.wikidata.org/wiki/Q1183700","display_name":"Deconvolution","level":2,"score":0.8280109167098999},{"id":"https://openalex.org/C15213710","wikidata":"https://www.wikidata.org/wiki/Q904207","display_name":"Ion-mobility spectrometry","level":3,"score":0.8155921697616577},{"id":"https://openalex.org/C138268822","wikidata":"https://www.wikidata.org/wiki/Q1051925","display_name":"Resolution (logic)","level":2,"score":0.6594511866569519},{"id":"https://openalex.org/C145148216","wikidata":"https://www.wikidata.org/wiki/Q36496","display_name":"Ion","level":2,"score":0.6417580842971802},{"id":"https://openalex.org/C113196181","wikidata":"https://www.wikidata.org/wiki/Q485223","display_name":"Analytical Chemistry (journal)","level":2,"score":0.5667015314102173},{"id":"https://openalex.org/C19275194","wikidata":"https://www.wikidata.org/wiki/Q222903","display_name":"Multiplexing","level":2,"score":0.5368673205375671},{"id":"https://openalex.org/C2992829418","wikidata":"https://www.wikidata.org/wiki/Q1255409","display_name":"Drift tube","level":3,"score":0.5090803503990173},{"id":"https://openalex.org/C162356407","wikidata":"https://www.wikidata.org/wiki/Q180809","display_name":"Mass spectrometry","level":2,"score":0.5069410800933838},{"id":"https://openalex.org/C2779843651","wikidata":"https://www.wikidata.org/wiki/Q7390335","display_name":"SIGNAL (programming language)","level":2,"score":0.4168110191822052},{"id":"https://openalex.org/C43617362","wikidata":"https://www.wikidata.org/wiki/Q170050","display_name":"Chromatography","level":1,"score":0.20725280046463013},{"id":"https://openalex.org/C11413529","wikidata":"https://www.wikidata.org/wiki/Q8366","display_name":"Algorithm","level":1,"score":0.12376123666763306},{"id":"https://openalex.org/C76155785","wikidata":"https://www.wikidata.org/wiki/Q418","display_name":"Telecommunications","level":1,"score":0.08117109537124634},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.06645265221595764},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.0},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","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":[{"descriptor_ui":"D000075663","descriptor_name":"Ion Mobility Spectrometry","qualifier_ui":"Q000295","qualifier_name":"instrumentation","is_major_topic":true},{"descriptor_ui":"D000075663","descriptor_name":"Ion Mobility Spectrometry","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":true},{"descriptor_ui":"D002241","descriptor_name":"Carbohydrates","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D007536","descriptor_name":"Isomerism","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008055","descriptor_name":"Lipids","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D012984","descriptor_name":"Software","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013058","descriptor_name":"Mass Spectrometry","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013997","descriptor_name":"Time Factors","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":2,"locations":[{"id":"doi:10.1021/acs.analchem.9b05718","doi":"https://doi.org/10.1021/acs.analchem.9b05718","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.analchem.9b05718","pdf_url":null,"source":{"id":"https://openalex.org/S191963794","display_name":"Analytical Chemistry","issn_l":"0003-2700","issn":["0003-2700","1520-6882"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-class-a","anvur-scientific","cwts-core","dongbi-a","doyens","jufo-3","ki-jl-2","medline","norway-2","poland-140","russia-white-list-1","vabb-shw"],"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":"Analytical Chemistry","raw_type":"journal-article"},{"id":"pmid:32628451","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/32628451","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,"listed_in":[],"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Analytical chemistry","raw_type":"Journal Article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[{"id":"https://openalex.org/G4967817215","display_name":"RAPID FLUX PHENOTYPING TO ACCELERATE METABOLIC ENGINEERING OF CYANOBACTERIA","funder_award_id":"DESC0019404","funder_id":"https://openalex.org/F4320332359","funder_display_name":"Office of Science"},{"id":"https://openalex.org/G6052167540","display_name":"Ion mobility based informatics and visualization strategies in support of metabolomics","funder_award_id":"R03CA222452","funder_id":"https://openalex.org/F4320337351","funder_display_name":"National Cancer Institute"}],"funders":[{"id":"https://openalex.org/F4320332359","display_name":"Office of Science","ror":"https://ror.org/00mmn6b08"},{"id":"https://openalex.org/F4320337351","display_name":"National Cancer Institute","ror":"https://ror.org/040gcmg81"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":84,"referenced_works":["https://openalex.org/W1490160191","https://openalex.org/W1514397955","https://openalex.org/W1549988612","https://openalex.org/W1665864650","https://openalex.org/W1840351579","https://openalex.org/W1866609041","https://openalex.org/W1889524658","https://openalex.org/W1897375905","https://openalex.org/W1964608017","https://openalex.org/W1971097535","https://openalex.org/W1981707733","https://openalex.org/W1986249771","https://openalex.org/W1987776753","https://openalex.org/W1988008969","https://openalex.org/W2001199194","https://openalex.org/W2002970223","https://openalex.org/W2011134129","https://openalex.org/W2019787708","https://openalex.org/W2019812098","https://openalex.org/W2023507717","https://openalex.org/W2026221456","https://openalex.org/W2028726006","https://openalex.org/W2031597060","https://openalex.org/W2045356813","https://openalex.org/W2045429446","https://openalex.org/W2048713936","https://openalex.org/W2049633694","https://openalex.org/W2049683636","https://openalex.org/W2053244619","https://openalex.org/W2055210083","https://openalex.org/W2056427971","https://openalex.org/W2056865451","https://openalex.org/W2057164176","https://openalex.org/W2058906815","https://openalex.org/W2059864180","https://openalex.org/W2060425922","https://openalex.org/W2072522369","https://openalex.org/W2073251096","https://openalex.org/W2073327318","https://openalex.org/W2086145691","https://openalex.org/W2088546850","https://openalex.org/W2088797680","https://openalex.org/W2089356562","https://openalex.org/W2092320159","https://openalex.org/W2093645477","https://openalex.org/W2094495776","https://openalex.org/W2103760553","https://openalex.org/W2121672113","https://openalex.org/W2135695370","https://openalex.org/W2136277253","https://openalex.org/W2143206354","https://openalex.org/W2150437455","https://openalex.org/W2150786597","https://openalex.org/W2150853464","https://openalex.org/W2160943571","https://openalex.org/W2162219833","https://openalex.org/W2217615546","https://openalex.org/W2223347777","https://openalex.org/W2285278534","https://openalex.org/W2315522560","https://openalex.org/W2317233863","https://openalex.org/W2331859302","https://openalex.org/W2338482498","https://openalex.org/W2507561431","https://openalex.org/W2507869595","https://openalex.org/W2560249609","https://openalex.org/W2565586364","https://openalex.org/W2572119288","https://openalex.org/W2601497469","https://openalex.org/W2610210647","https://openalex.org/W2621637707","https://openalex.org/W2740977550","https://openalex.org/W2755377387","https://openalex.org/W2766139085","https://openalex.org/W2769060593","https://openalex.org/W2794274887","https://openalex.org/W2894247667","https://openalex.org/W2900639329","https://openalex.org/W2902734986","https://openalex.org/W2921738524","https://openalex.org/W2925296437","https://openalex.org/W2947791494","https://openalex.org/W2957807452","https://openalex.org/W3150891533"],"related_works":["https://openalex.org/W1866609041","https://openalex.org/W2769060593","https://openalex.org/W4402534430","https://openalex.org/W2073327318","https://openalex.org/W1840351579","https://openalex.org/W2794920528","https://openalex.org/W2489194202","https://openalex.org/W2056427971","https://openalex.org/W3137941695","https://openalex.org/W4292444200"],"abstract_inverted_index":{"Abstract":[0],"A":[1,74],"combined":[2],"data":[3,6,58,172],"acquisition":[4],"and":[5,13,36,54,88,130,157,169],"processing":[7],"strategy":[8,22,43],"for":[9,149],"improving":[10],"the":[11,70,150],"sensitivity":[12],"resolution":[14,63,68,128],"of":[15,76,121,126,144],"ion":[16,31,41,52,71,188],"mobility":[17,72,189],"measurements":[18],"is":[19,23],"described.":[20],"This":[21],"implemented":[24],"on":[25],"a":[26,55,109],"commercially":[27],"available":[28],"drift":[29,103,158],"tube":[30],"mobility-mass":[32],"spectrometry":[33],"(IM-MS)":[34],"instrument":[35],"utilizes":[37],"both":[38],"an":[39,48,139],"existing":[40],"multiplexing":[42],"to":[44,47,66,117,147,164,182],"achieve":[45],"up":[46],"8-fold":[49],"gain":[50],"in":[51,69,102],"signal":[53],"new":[56],"postacquisition":[57],"reconstruction":[59],"technique,":[60],"termed":[61],"\u201chigh":[62],"demultiplexing\u201d":[64],"(HRdm),":[65],"improve":[67],"dimension.":[73],"series":[75],"isomeric":[77],"mixtures":[78],"were":[79,91,162],"qualitatively":[80],"investigated":[81],"with":[82,138],"HRdm,":[83,95],"including":[84,96],"biologically":[85],"relevant":[86],"lipids":[87],"carbohydrates,":[89],"which":[90,100,174],"successfully":[92],"resolved":[93],"by":[94,105],"two":[97],"monosaccharide":[98],"regioisomers":[99],"differed":[101],"time":[104,159],"only":[106],"0.8%.":[107],"For":[108],"complex":[110],"trisaccharide":[111],"isomer":[112],"mixture,":[113],"HRdm":[114,136,170],"was":[115],"able":[116],"resolve":[118],"5":[119],"out":[120],"6":[122],"components.":[123],"An":[124],"analysis":[125,155],"two-peak":[127],"(Rpp)":[129],"peak-to-peak":[131],"separation":[132],"(\u0394P)":[133],"indicated":[134],"that":[135],"performs":[137],"effective":[140],"resolving":[141],"power":[142],"(Rp)":[143],"between":[145,167],"180":[146],"250":[148],"highest":[151],"deconvolution":[152],"settings.":[153],"Overall":[154],"times":[156],"measurement":[160],"precision":[161],"found":[163],"be":[165,183],"unaffected":[166],"standard":[168],"processed":[171],"sets,":[173],"allowed":[175],"statistically":[176],"identical":[177],"collision":[178],"cross":[179],"section":[180],"values":[181],"directly":[184],"determined":[185],"from":[186],"all":[187],"spectra.":[190]},"counts_by_year":[{"year":2026,"cited_by_count":8},{"year":2025,"cited_by_count":11},{"year":2024,"cited_by_count":23},{"year":2023,"cited_by_count":25},{"year":2022,"cited_by_count":23},{"year":2021,"cited_by_count":17},{"year":2020,"cited_by_count":1}],"updated_date":"2026-11-04T10:54:05.112534","created_date":"2020-07-10T00:00:00"}
