{"id":"https://openalex.org/W4291302671","doi":"https://doi.org/10.1007/978-3-031-13829-4_24","title":"Elucidating Quantum Semi-empirical Based QSAR, for Predicting Tannins\u2019 Anti-oxidant Activity with the Help of Artificial Neural Network","display_name":"Elucidating Quantum Semi-empirical Based QSAR, for Predicting Tannins\u2019 Anti-oxidant Activity with the Help of Artificial Neural Network","publication_year":2022,"publication_date":"2022-01-01","ids":{"openalex":"https://openalex.org/W4291302671","doi":"https://doi.org/10.1007/978-3-031-13829-4_24"},"language":"en","primary_location":{"id":"doi:10.1007/978-3-031-13829-4_24","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-031-13829-4_24","pdf_url":null,"source":{"id":"https://openalex.org/S106296714","display_name":"Lecture notes in computer science","issn_l":"0302-9743","issn":["0302-9743","1611-3349"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"book series"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Lecture Notes in Computer Science","raw_type":"book-chapter"},"type":"conference-paper","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/A5103070886","display_name":"Chandrasekhar Gopalakrishnan","orcid":"https://orcid.org/0000-0001-5019-2715"},"institutions":[{"id":"https://openalex.org/I876193797","display_name":"Vellore Institute of Technology University","ror":"https://ror.org/00qzypv28","country_code":"IN","type":"education","lineage":["https://openalex.org/I876193797"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"Chandrasekhar Gopalakrishnan","raw_affiliation_strings":["Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India","institution_ids":["https://openalex.org/I876193797"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5102728698","display_name":"Caixia Xu","orcid":"https://orcid.org/0000-0002-6489-8759"},"institutions":[{"id":"https://openalex.org/I198959115","display_name":"Changzhi Medical College","ror":"https://ror.org/0340wst14","country_code":"CN","type":"education","lineage":["https://openalex.org/I198959115"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Caixia Xu","raw_affiliation_strings":["Changzhi Medical College, Changzhi, 046000, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Changzhi Medical College, Changzhi, 046000, China","institution_ids":["https://openalex.org/I198959115"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5101698008","display_name":"Yanran Li","orcid":"https://orcid.org/0000-0003-1385-7604"},"institutions":[{"id":"https://openalex.org/I154093214","display_name":"Xinjiang Medical University","ror":"https://ror.org/01p455v08","country_code":"CN","type":"education","lineage":["https://openalex.org/I154093214"]},{"id":"https://openalex.org/I2802734952","display_name":"First Affiliated Hospital of Xinjiang Medical University","ror":"https://ror.org/02qx1ae98","country_code":"CN","type":"healthcare","lineage":["https://openalex.org/I2802734952"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Yanran Li","raw_affiliation_strings":["Department of Radiology, The First Affiliated Hospital of Xinjiang Medical University, Urumqi, 830054, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Radiology, The First Affiliated Hospital of Xinjiang Medical University, Urumqi, 830054, China","institution_ids":["https://openalex.org/I154093214","https://openalex.org/I2802734952"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5070546499","display_name":"Vinutha Anandhan","orcid":null},"institutions":[{"id":"https://openalex.org/I876193797","display_name":"Vellore Institute of Technology University","ror":"https://ror.org/00qzypv28","country_code":"IN","type":"education","lineage":["https://openalex.org/I876193797"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"Vinutha Anandhan","raw_affiliation_strings":["Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India","institution_ids":["https://openalex.org/I876193797"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5108612228","display_name":"Sanjay Gangadharan","orcid":null},"institutions":[{"id":"https://openalex.org/I876193797","display_name":"Vellore Institute of Technology University","ror":"https://ror.org/00qzypv28","country_code":"IN","type":"education","lineage":["https://openalex.org/I876193797"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"Sanjay Gangadharan","raw_affiliation_strings":["Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India","institution_ids":["https://openalex.org/I876193797"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5046890976","display_name":"Meshach Paul","orcid":null},"institutions":[{"id":"https://openalex.org/I876193797","display_name":"Vellore Institute of Technology University","ror":"https://ror.org/00qzypv28","country_code":"IN","type":"education","lineage":["https://openalex.org/I876193797"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"Meshach Paul","raw_affiliation_strings":["Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India","institution_ids":["https://openalex.org/I876193797"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5018636359","display_name":"Chandra Sekar Ponnusamy","orcid":"https://orcid.org/0000-0001-5986-6501"},"institutions":[{"id":"https://openalex.org/I876193797","display_name":"Vellore Institute of Technology University","ror":"https://ror.org/00qzypv28","country_code":"IN","type":"education","lineage":["https://openalex.org/I876193797"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"Chandra Sekar Ponnusamy","raw_affiliation_strings":["Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India","institution_ids":["https://openalex.org/I876193797"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5100628263","display_name":"R. Rajasekaran","orcid":null},"institutions":[{"id":"https://openalex.org/I876193797","display_name":"Vellore Institute of Technology University","ror":"https://ror.org/00qzypv28","country_code":"IN","type":"education","lineage":["https://openalex.org/I876193797"]}],"countries":["IN"],"is_corresponding":true,"raw_author_name":"Rajasekaran Ramalingam","raw_affiliation_strings":["Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Quantitative Biology Lab, Department of Biotechnology, School of Bio Sciences and Technology, Vellore Institute of Technology (Deemed to be University), 632014, Vellore, Tamil Nadu, India","institution_ids":["https://openalex.org/I876193797"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5100454714","display_name":"Pengyong Han","orcid":null},"institutions":[{"id":"https://openalex.org/I198959115","display_name":"Changzhi Medical College","ror":"https://ror.org/0340wst14","country_code":"CN","type":"education","lineage":["https://openalex.org/I198959115"]}],"countries":["CN"],"is_corresponding":true,"raw_author_name":"Pengyong Han","raw_affiliation_strings":["Changzhi Medical College, Changzhi, 046000, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Changzhi Medical College, Changzhi, 046000, China","institution_ids":["https://openalex.org/I198959115"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5100734156","display_name":"Zhengwei Li","orcid":"https://orcid.org/0000-0003-1644-1006"},"institutions":[{"id":"https://openalex.org/I25757504","display_name":"China University of Mining and Technology","ror":"https://ror.org/01xt2dr21","country_code":"CN","type":"education","lineage":["https://openalex.org/I25757504"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Zhengwei Li","raw_affiliation_strings":["School of Computer Science and Technology, China University of Mining and Technology, Xuzhou, 221116, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"School of Computer Science and Technology, China University of Mining and Technology, Xuzhou, 221116, China","institution_ids":["https://openalex.org/I25757504"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":5,"corresponding_author_ids":["https://openalex.org/A5100454714","https://openalex.org/A5100628263"],"corresponding_institution_ids":["https://openalex.org/I198959115","https://openalex.org/I876193797"],"apc_list":{"value":5000,"currency":"EUR","value_usd":5392},"apc_paid":null,"fwci":2.3214,"has_fulltext":false,"cited_by_count":1,"citation_normalized_percentile":{"value":0.86661754,"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":"289","last_page":"301"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T13013","display_name":"Free Radicals and Antioxidants","score":0.9995999932289124,"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":0.9995999932289124,"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/T10211","display_name":"Computational Drug Discovery Methods","score":0.9991000294685364,"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/T10035","display_name":"Phytochemicals and Antioxidant Activities","score":0.9987000226974487,"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/quantitative-structure\u2013activity-relationship","display_name":"Quantitative structure\u2013activity relationship","score":0.8997097611427307},{"id":"https://openalex.org/keywords/artificial-neural-network","display_name":"Artificial neural network","score":0.753445565700531},{"id":"https://openalex.org/keywords/feature-selection","display_name":"Feature selection","score":0.7235510349273682},{"id":"https://openalex.org/keywords/tannin","display_name":"Tannin","score":0.6588825583457947},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.5835906267166138},{"id":"https://openalex.org/keywords/artificial-intelligence","display_name":"Artificial intelligence","score":0.581180989742279},{"id":"https://openalex.org/keywords/machine-learning","display_name":"Machine learning","score":0.4979996681213379},{"id":"https://openalex.org/keywords/pipeline","display_name":"Pipeline (software)","score":0.4955240488052368},{"id":"https://openalex.org/keywords/feature","display_name":"Feature (linguistics)","score":0.4907921254634857},{"id":"https://openalex.org/keywords/quantum-chemical","display_name":"Quantum chemical","score":0.4902418255805969},{"id":"https://openalex.org/keywords/linear-regression","display_name":"Linear regression","score":0.43889063596725464},{"id":"https://openalex.org/keywords/pattern-recognition","display_name":"Pattern recognition (psychology)","score":0.3605596423149109},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.20579156279563904},{"id":"https://openalex.org/keywords/botany","display_name":"Botany","score":0.11189055442810059},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.10216426849365234},{"id":"https://openalex.org/keywords/organic-chemistry","display_name":"Organic chemistry","score":0.08269774913787842}],"concepts":[{"id":"https://openalex.org/C164126121","wikidata":"https://www.wikidata.org/wiki/Q766383","display_name":"Quantitative structure\u2013activity relationship","level":2,"score":0.8997097611427307},{"id":"https://openalex.org/C50644808","wikidata":"https://www.wikidata.org/wiki/Q192776","display_name":"Artificial neural network","level":2,"score":0.753445565700531},{"id":"https://openalex.org/C148483581","wikidata":"https://www.wikidata.org/wiki/Q446488","display_name":"Feature selection","level":2,"score":0.7235510349273682},{"id":"https://openalex.org/C2780309462","wikidata":"https://www.wikidata.org/wiki/Q187607","display_name":"Tannin","level":2,"score":0.6588825583457947},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.5835906267166138},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.581180989742279},{"id":"https://openalex.org/C119857082","wikidata":"https://www.wikidata.org/wiki/Q2539","display_name":"Machine learning","level":1,"score":0.4979996681213379},{"id":"https://openalex.org/C43521106","wikidata":"https://www.wikidata.org/wiki/Q2165493","display_name":"Pipeline (software)","level":2,"score":0.4955240488052368},{"id":"https://openalex.org/C2776401178","wikidata":"https://www.wikidata.org/wiki/Q12050496","display_name":"Feature (linguistics)","level":2,"score":0.4907921254634857},{"id":"https://openalex.org/C2991951333","wikidata":"https://www.wikidata.org/wiki/Q188403","display_name":"Quantum chemical","level":3,"score":0.4902418255805969},{"id":"https://openalex.org/C48921125","wikidata":"https://www.wikidata.org/wiki/Q10861030","display_name":"Linear regression","level":2,"score":0.43889063596725464},{"id":"https://openalex.org/C153180895","wikidata":"https://www.wikidata.org/wiki/Q7148389","display_name":"Pattern recognition (psychology)","level":2,"score":0.3605596423149109},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.20579156279563904},{"id":"https://openalex.org/C59822182","wikidata":"https://www.wikidata.org/wiki/Q441","display_name":"Botany","level":1,"score":0.11189055442810059},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.10216426849365234},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.08269774913787842},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.0},{"id":"https://openalex.org/C41895202","wikidata":"https://www.wikidata.org/wiki/Q8162","display_name":"Linguistics","level":1,"score":0.0},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.0},{"id":"https://openalex.org/C138885662","wikidata":"https://www.wikidata.org/wiki/Q5891","display_name":"Philosophy","level":0,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1007/978-3-031-13829-4_24","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-031-13829-4_24","pdf_url":null,"source":{"id":"https://openalex.org/S106296714","display_name":"Lecture notes in computer science","issn_l":"0302-9743","issn":["0302-9743","1611-3349"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"book series"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Lecture Notes in Computer Science","raw_type":"book-chapter"}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":35,"referenced_works":["https://openalex.org/W1966676314","https://openalex.org/W1969068377","https://openalex.org/W1985691658","https://openalex.org/W2022386443","https://openalex.org/W2023536393","https://openalex.org/W2029876794","https://openalex.org/W2031896371","https://openalex.org/W2032948249","https://openalex.org/W2034109502","https://openalex.org/W2061903067","https://openalex.org/W2066411725","https://openalex.org/W2077973224","https://openalex.org/W2081567076","https://openalex.org/W2157565326","https://openalex.org/W2163601688","https://openalex.org/W2177317049","https://openalex.org/W2793405960","https://openalex.org/W2800951902","https://openalex.org/W2805691066","https://openalex.org/W2886028207","https://openalex.org/W2888175587","https://openalex.org/W2901719664","https://openalex.org/W2918377333","https://openalex.org/W2937074474","https://openalex.org/W2944691679","https://openalex.org/W2951256269","https://openalex.org/W2951320041","https://openalex.org/W2970487695","https://openalex.org/W2974389792","https://openalex.org/W2982188507","https://openalex.org/W3119610803","https://openalex.org/W3123964578","https://openalex.org/W3152566237","https://openalex.org/W4229604995","https://openalex.org/W4300935349"],"related_works":["https://openalex.org/W2382340815","https://openalex.org/W1972650408","https://openalex.org/W2551736466","https://openalex.org/W1997566113","https://openalex.org/W3189652131","https://openalex.org/W2908740012","https://openalex.org/W1967793880","https://openalex.org/W2792066564","https://openalex.org/W1186905254","https://openalex.org/W2898703579"],"abstract_inverted_index":null,"counts_by_year":[{"year":2022,"cited_by_count":1}],"updated_date":"2026-08-04T08:18:43.703281","created_date":"2025-10-10T00:00:00"}