{"id":"https://openalex.org/W2217873477","doi":"https://doi.org/10.1109/bibe.2015.7367647","title":"DFT investigation of the reaction of cyanidin with hydroxyl radical","display_name":"DFT investigation of the reaction of cyanidin with hydroxyl radical","publication_year":2015,"publication_date":"2015-11-01","ids":{"openalex":"https://openalex.org/W2217873477","doi":"https://doi.org/10.1109/bibe.2015.7367647","mag":"2217873477"},"language":"en","primary_location":{"id":"doi:10.1109/bibe.2015.7367647","is_oa":false,"landing_page_url":"https://doi.org/10.1109/bibe.2015.7367647","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"2015 IEEE 15th International Conference on Bioinformatics and Bioengineering (BIBE)","raw_type":"proceedings-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/A5090923981","display_name":"Dejan Milenkovi\u0107","orcid":"https://orcid.org/0000-0001-7083-2257"},"institutions":[{"id":"https://openalex.org/I14245010","display_name":"University of Kragujevac","ror":"https://ror.org/04f7vj627","country_code":"RS","type":"education","lineage":["https://openalex.org/I14245010"]}],"countries":["RS"],"is_corresponding":true,"raw_author_name":"Dejan A. Milenkovic","raw_affiliation_strings":["Bioengineering Research and Development Center, Kragujevac, Republic of Serbia"],"affiliations":[{"raw_affiliation_string":"Bioengineering Research and Development Center, Kragujevac, Republic of Serbia","institution_ids":["https://openalex.org/I14245010"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5041173996","display_name":"Jasmina M. Dimitri\u0107 Markovi\u0107","orcid":"https://orcid.org/0000-0003-4796-6251"},"institutions":[{"id":"https://openalex.org/I4068193","display_name":"University of Belgrade","ror":"https://ror.org/02qsmb048","country_code":"RS","type":"education","lineage":["https://openalex.org/I4068193"]}],"countries":["RS"],"is_corresponding":false,"raw_author_name":"Jasmina M. Dimitric Markovic","raw_affiliation_strings":["Faculty of Physical ChemistryRepublic of Serbia, University of Belgradec, Belgrade, Republic of Serbia"],"affiliations":[{"raw_affiliation_string":"Faculty of Physical ChemistryRepublic of Serbia, University of Belgradec, Belgrade, Republic of Serbia","institution_ids":["https://openalex.org/I4068193"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5077823854","display_name":"Zoran Markovi\u0107","orcid":"https://orcid.org/0000-0001-5964-049X"},"institutions":[{"id":"https://openalex.org/I207056914","display_name":"State University of Novi Pazar","ror":"https://ror.org/00ggq9r86","country_code":"RS","type":"education","lineage":["https://openalex.org/I207056914"]}],"countries":["RS"],"is_corresponding":false,"raw_author_name":"Zoran S. Markovic","raw_affiliation_strings":["Department of Chemical-Technological Sciences, State University of Novi Pazar, Novi Pazar, Serbia"],"affiliations":[{"raw_affiliation_string":"Department of Chemical-Technological Sciences, State University of Novi Pazar, Novi Pazar, Serbia","institution_ids":["https://openalex.org/I207056914"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":3,"corresponding_author_ids":["https://openalex.org/A5090923981"],"corresponding_institution_ids":["https://openalex.org/I14245010"],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":2,"citation_normalized_percentile":{"value":0.07262304,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":94},"biblio":{"volume":null,"issue":null,"first_page":"1","last_page":"5"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T13013","display_name":"Free Radicals and Antioxidants","score":1.0,"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"}},"topics":[{"id":"https://openalex.org/T13013","display_name":"Free Radicals and Antioxidants","score":1.0,"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"}},{"id":"https://openalex.org/T11129","display_name":"Photochemistry and Electron Transfer Studies","score":0.9926000237464905,"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/T10445","display_name":"Antioxidant Activity and Oxidative Stress","score":0.9667999744415283,"subfield":{"id":"https://openalex.org/subfields/2704","display_name":"Biochemistry"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/cyanidin","display_name":"Cyanidin","score":0.8578826189041138},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.7841740846633911},{"id":"https://openalex.org/keywords/hydroxyl-radical","display_name":"Hydroxyl radical","score":0.6373685598373413},{"id":"https://openalex.org/keywords/dissociation","display_name":"Dissociation (chemistry)","score":0.5822134017944336},{"id":"https://openalex.org/keywords/radical","display_name":"Radical","score":0.5446876287460327},{"id":"https://openalex.org/keywords/reaction-mechanism","display_name":"Reaction mechanism","score":0.5301775932312012},{"id":"https://openalex.org/keywords/proton-affinity","display_name":"Proton affinity","score":0.4813721776008606},{"id":"https://openalex.org/keywords/photochemistry","display_name":"Photochemistry","score":0.44219374656677246},{"id":"https://openalex.org/keywords/organic-chemistry","display_name":"Organic chemistry","score":0.21826523542404175},{"id":"https://openalex.org/keywords/pigment","display_name":"Pigment","score":0.1785089373588562},{"id":"https://openalex.org/keywords/protonation","display_name":"Protonation","score":0.0987769067287445},{"id":"https://openalex.org/keywords/catalysis","display_name":"Catalysis","score":0.07105851173400879}],"concepts":[{"id":"https://openalex.org/C2777667348","wikidata":"https://www.wikidata.org/wiki/Q417606","display_name":"Cyanidin","level":3,"score":0.8578826189041138},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.7841740846633911},{"id":"https://openalex.org/C2776778087","wikidata":"https://www.wikidata.org/wiki/Q427071","display_name":"Hydroxyl radical","level":3,"score":0.6373685598373413},{"id":"https://openalex.org/C102931765","wikidata":"https://www.wikidata.org/wiki/Q189673","display_name":"Dissociation (chemistry)","level":2,"score":0.5822134017944336},{"id":"https://openalex.org/C139066938","wikidata":"https://www.wikidata.org/wiki/Q185056","display_name":"Radical","level":2,"score":0.5446876287460327},{"id":"https://openalex.org/C65024703","wikidata":"https://www.wikidata.org/wiki/Q373406","display_name":"Reaction mechanism","level":3,"score":0.5301775932312012},{"id":"https://openalex.org/C53323650","wikidata":"https://www.wikidata.org/wiki/Q1118362","display_name":"Proton affinity","level":4,"score":0.4813721776008606},{"id":"https://openalex.org/C75473681","wikidata":"https://www.wikidata.org/wiki/Q188651","display_name":"Photochemistry","level":1,"score":0.44219374656677246},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.21826523542404175},{"id":"https://openalex.org/C64584667","wikidata":"https://www.wikidata.org/wiki/Q161179","display_name":"Pigment","level":2,"score":0.1785089373588562},{"id":"https://openalex.org/C30095370","wikidata":"https://www.wikidata.org/wiki/Q899488","display_name":"Protonation","level":3,"score":0.0987769067287445},{"id":"https://openalex.org/C161790260","wikidata":"https://www.wikidata.org/wiki/Q82264","display_name":"Catalysis","level":2,"score":0.07105851173400879},{"id":"https://openalex.org/C145148216","wikidata":"https://www.wikidata.org/wiki/Q36496","display_name":"Ion","level":2,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1109/bibe.2015.7367647","is_oa":false,"landing_page_url":"https://doi.org/10.1109/bibe.2015.7367647","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"2015 IEEE 15th International Conference on Bioinformatics and Bioengineering (BIBE)","raw_type":"proceedings-article"}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":23,"referenced_works":["https://openalex.org/W1972040015","https://openalex.org/W1980770514","https://openalex.org/W2001984353","https://openalex.org/W2003395155","https://openalex.org/W2011254772","https://openalex.org/W2020112199","https://openalex.org/W2021193100","https://openalex.org/W2035196826","https://openalex.org/W2037939062","https://openalex.org/W2056343330","https://openalex.org/W2065833646","https://openalex.org/W2085375471","https://openalex.org/W2090285741","https://openalex.org/W2091237955","https://openalex.org/W2109816957","https://openalex.org/W2134181676","https://openalex.org/W2154665428","https://openalex.org/W2156279367","https://openalex.org/W2171445884","https://openalex.org/W2240761559","https://openalex.org/W2335744895","https://openalex.org/W2495262158","https://openalex.org/W4322702936"],"related_works":["https://openalex.org/W2001831785","https://openalex.org/W2016154305","https://openalex.org/W2018557021","https://openalex.org/W2026648049","https://openalex.org/W2168395835","https://openalex.org/W2036498181","https://openalex.org/W1974385684","https://openalex.org/W2065290829","https://openalex.org/W2072519158","https://openalex.org/W2003237668"],"abstract_inverted_index":{"Cyanidin,":[0],"as":[1],"one":[2],"important":[3],"plant":[4],"pigment,":[5],"was":[6],"theoretically":[7],"(at":[8],"M05-2X/6-311+G(d,":[9],"p)":[10],"level":[11],"of":[12,54,75,83,86],"theory)":[13],"investigated":[14],"for":[15,51,72],"its":[16],"ability":[17],"to":[18],"scavenge":[19],"potentially,":[20],"highly":[21],"damaging":[22],"hydroxyl":[23,92],"radical.":[24],"The":[25,43],"applied":[26],"method":[27],"successfully":[28],"reproduces":[29],"the":[30,35,57,61,64,78,91,98,103,108],"bond":[31],"dissociation":[32],"enthalpy":[33],"(BDE),":[34],"ionization":[36],"potential":[37],"(IP)":[38],"and":[39,106],"proton":[40],"affinity":[41],"(PA).":[42],"HAT":[44,96],"mechanism":[45,66],"is":[46,67,97,111],"most":[47,68,112],"favorable":[48,69],"reaction":[49,70,89,100],"pathway":[50,71,101],"antioxidative":[52,73,84],"action":[53,74,85],"cyanidin":[55,76,87],"in":[56,77,88,102],"gas":[58,104],"phase.":[59,80],"On":[60],"other":[62],"hand,":[63],"SPLET":[65],"aqueous":[79],"Mechanistic":[81],"investigations":[82],"with":[90],"radical":[93],"confirmed":[94],"that":[95,107],"dominant":[99],"phase,":[105],"4'":[109],"position":[110],"reactive.":[113]},"counts_by_year":[{"year":2024,"cited_by_count":1},{"year":2021,"cited_by_count":1}],"updated_date":"2025-11-06T03:46:38.306776","created_date":"2025-10-10T00:00:00"}