{"id":"https://openalex.org/W2260780855","doi":"https://doi.org/10.1007/978-3-319-23485-4_33","title":"Variable Elimination Approaches for Data-Noise Reduction in 3D QSAR Calculations","display_name":"Variable Elimination Approaches for Data-Noise Reduction in 3D QSAR Calculations","publication_year":2015,"publication_date":"2015-01-01","ids":{"openalex":"https://openalex.org/W2260780855","doi":"https://doi.org/10.1007/978-3-319-23485-4_33","mag":"2260780855"},"language":"en","primary_location":{"id":"doi:10.1007/978-3-319-23485-4_33","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-319-23485-4_33","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":"book-chapter","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/A5026816800","display_name":"Rafael Dole\u017eal","orcid":"https://orcid.org/0000-0001-9495-3934"},"institutions":[{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]},{"id":"https://openalex.org/I4210137570","display_name":"University Hospital Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/04wckhb82","country_code":"CZ","type":"funder","lineage":["https://openalex.org/I4210137570"]}],"countries":["CZ"],"is_corresponding":true,"raw_author_name":"Rafael Dolezal","raw_affiliation_strings":["Biomedical Research Center, University Hospital Hradec Kralove, Hradec Kralove, Czech Republic","Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Biomedical Research Center, University Hospital Hradec Kralove, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I4210137570"]},{"raw_affiliation_string":"Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5056799399","display_name":"Ag\u00e1ta Bodn\u00e1rov\u00e1","orcid":null},"institutions":[{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]}],"countries":["CZ"],"is_corresponding":false,"raw_author_name":"Agata Bodnarova","raw_affiliation_strings":["Department of Information Technologies, Faculty of Informatics and Management, University of Hradec Kralove, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Department of Information Technologies, Faculty of Informatics and Management, University of Hradec Kralove, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5021405554","display_name":"Richard Cimler","orcid":"https://orcid.org/0000-0001-6712-9894"},"institutions":[{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]}],"countries":["CZ"],"is_corresponding":false,"raw_author_name":"Richard Cimler","raw_affiliation_strings":["Department of Information Technologies, Faculty of Informatics and Management, University of Hradec Kralove, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Department of Information Technologies, Faculty of Informatics and Management, University of Hradec Kralove, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5061937786","display_name":"Martina Hus\u00e1kov\u00e1","orcid":"https://orcid.org/0000-0003-1116-4556"},"institutions":[{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]}],"countries":["CZ"],"is_corresponding":false,"raw_author_name":"Martina Husakova","raw_affiliation_strings":["Department of Information Technologies, Faculty of Informatics and Management, University of Hradec Kralove, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Department of Information Technologies, Faculty of Informatics and Management, University of Hradec Kralove, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5046890085","display_name":"Lukas Najman","orcid":null},"institutions":[{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]}],"countries":["CZ"],"is_corresponding":false,"raw_author_name":"Lukas Najman","raw_affiliation_strings":["Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5025578676","display_name":"Veronika Ra\u010d\u00e1kov\u00e1","orcid":null},"institutions":[{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]}],"countries":["CZ"],"is_corresponding":false,"raw_author_name":"Veronika Racakova","raw_affiliation_strings":["Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5000700030","display_name":"Ji\u0159\u00ed K\u0159enek","orcid":null},"institutions":[{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]}],"countries":["CZ"],"is_corresponding":false,"raw_author_name":"Jiri Krenek","raw_affiliation_strings":["Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5087115321","display_name":"Jan Kor\u00e1be\u010dn\u00fd","orcid":"https://orcid.org/0000-0001-6977-7596"},"institutions":[{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]},{"id":"https://openalex.org/I4210137570","display_name":"University Hospital Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/04wckhb82","country_code":"CZ","type":"funder","lineage":["https://openalex.org/I4210137570"]}],"countries":["CZ"],"is_corresponding":false,"raw_author_name":"Jan Korabecny","raw_affiliation_strings":["Biomedical Research Center, University Hospital Hradec Kralove, Hradec Kralove, Czech Republic","Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Biomedical Research Center, University Hospital Hradec Kralove, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I4210137570"]},{"raw_affiliation_string":"Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5066903927","display_name":"Kamil Ku\u010da","orcid":"https://orcid.org/0000-0001-9664-1109"},"institutions":[{"id":"https://openalex.org/I4210137570","display_name":"University Hospital Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/04wckhb82","country_code":"CZ","type":"funder","lineage":["https://openalex.org/I4210137570"]},{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]}],"countries":["CZ"],"is_corresponding":false,"raw_author_name":"Kamil Kuca","raw_affiliation_strings":["Biomedical Research Center, University Hospital Hradec Kralove, Hradec Kralove, Czech Republic","Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Biomedical Research Center, University Hospital Hradec Kralove, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I4210137570"]},{"raw_affiliation_string":"Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5045569977","display_name":"Ond\u0159ej Krejcar","orcid":"https://orcid.org/0000-0002-5992-2574"},"institutions":[{"id":"https://openalex.org/I75092371","display_name":"University of Hradec Kr\u00e1lov\u00e9","ror":"https://ror.org/05k238v14","country_code":"CZ","type":"education","lineage":["https://openalex.org/I75092371"]}],"countries":["CZ"],"is_corresponding":false,"raw_author_name":"Ondrej Krejcar","raw_affiliation_strings":["Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic"],"affiliations":[{"raw_affiliation_string":"Center for Basic and Applied Research, Faculty of Informatics and Management, University of Hradec Kralove, Rokitanskeho 62, 50003, Hradec Kralove, Czech Republic","institution_ids":["https://openalex.org/I75092371"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":10,"corresponding_author_ids":["https://openalex.org/A5026816800"],"corresponding_institution_ids":["https://openalex.org/I4210137570","https://openalex.org/I75092371"],"apc_list":{"value":5000,"currency":"EUR","value_usd":5392},"apc_paid":null,"fwci":0.9255,"has_fulltext":false,"cited_by_count":4,"citation_normalized_percentile":{"value":0.75055383,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":96},"biblio":{"volume":null,"issue":null,"first_page":"313","last_page":"325"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9995999932289124,"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"}},"topics":[{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9995999932289124,"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/T10640","display_name":"Spectroscopy and Chemometric Analyses","score":0.9979000091552734,"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/T10908","display_name":"Analytical Chemistry and Chromatography","score":0.9930999875068665,"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/quantitative-structure\u2013activity-relationship","display_name":"Quantitative structure\u2013activity relationship","score":0.865016520023346},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.7494247555732727},{"id":"https://openalex.org/keywords/variable-elimination","display_name":"Variable elimination","score":0.6091189384460449},{"id":"https://openalex.org/keywords/reduction","display_name":"Reduction (mathematics)","score":0.5131012201309204},{"id":"https://openalex.org/keywords/variable","display_name":"Variable (mathematics)","score":0.5038964152336121},{"id":"https://openalex.org/keywords/regression","display_name":"Regression","score":0.45857128500938416},{"id":"https://openalex.org/keywords/data-mining","display_name":"Data mining","score":0.4533819258213043},{"id":"https://openalex.org/keywords/partial-least-squares-regression","display_name":"Partial least squares regression","score":0.44873717427253723},{"id":"https://openalex.org/keywords/noise","display_name":"Noise (video)","score":0.4318862557411194},{"id":"https://openalex.org/keywords/artificial-intelligence","display_name":"Artificial intelligence","score":0.3823515772819519},{"id":"https://openalex.org/keywords/machine-learning","display_name":"Machine learning","score":0.3808412551879883},{"id":"https://openalex.org/keywords/algorithm","display_name":"Algorithm","score":0.34543102979660034},{"id":"https://openalex.org/keywords/mathematics","display_name":"Mathematics","score":0.1859557032585144},{"id":"https://openalex.org/keywords/statistics","display_name":"Statistics","score":0.13790211081504822}],"concepts":[{"id":"https://openalex.org/C164126121","wikidata":"https://www.wikidata.org/wiki/Q766383","display_name":"Quantitative structure\u2013activity relationship","level":2,"score":0.865016520023346},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.7494247555732727},{"id":"https://openalex.org/C169272836","wikidata":"https://www.wikidata.org/wiki/Q5668307","display_name":"Variable elimination","level":3,"score":0.6091189384460449},{"id":"https://openalex.org/C111335779","wikidata":"https://www.wikidata.org/wiki/Q3454686","display_name":"Reduction (mathematics)","level":2,"score":0.5131012201309204},{"id":"https://openalex.org/C182365436","wikidata":"https://www.wikidata.org/wiki/Q50701","display_name":"Variable (mathematics)","level":2,"score":0.5038964152336121},{"id":"https://openalex.org/C83546350","wikidata":"https://www.wikidata.org/wiki/Q1139051","display_name":"Regression","level":2,"score":0.45857128500938416},{"id":"https://openalex.org/C124101348","wikidata":"https://www.wikidata.org/wiki/Q172491","display_name":"Data mining","level":1,"score":0.4533819258213043},{"id":"https://openalex.org/C22354355","wikidata":"https://www.wikidata.org/wiki/Q422009","display_name":"Partial least squares regression","level":2,"score":0.44873717427253723},{"id":"https://openalex.org/C99498987","wikidata":"https://www.wikidata.org/wiki/Q2210247","display_name":"Noise (video)","level":3,"score":0.4318862557411194},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.3823515772819519},{"id":"https://openalex.org/C119857082","wikidata":"https://www.wikidata.org/wiki/Q2539","display_name":"Machine learning","level":1,"score":0.3808412551879883},{"id":"https://openalex.org/C11413529","wikidata":"https://www.wikidata.org/wiki/Q8366","display_name":"Algorithm","level":1,"score":0.34543102979660034},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.1859557032585144},{"id":"https://openalex.org/C105795698","wikidata":"https://www.wikidata.org/wiki/Q12483","display_name":"Statistics","level":1,"score":0.13790211081504822},{"id":"https://openalex.org/C115961682","wikidata":"https://www.wikidata.org/wiki/Q860623","display_name":"Image (mathematics)","level":2,"score":0.0},{"id":"https://openalex.org/C134306372","wikidata":"https://www.wikidata.org/wiki/Q7754","display_name":"Mathematical analysis","level":1,"score":0.0},{"id":"https://openalex.org/C2524010","wikidata":"https://www.wikidata.org/wiki/Q8087","display_name":"Geometry","level":1,"score":0.0},{"id":"https://openalex.org/C2776214188","wikidata":"https://www.wikidata.org/wiki/Q408386","display_name":"Inference","level":2,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1007/978-3-319-23485-4_33","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-319-23485-4_33","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":[{"score":0.7099999785423279,"id":"https://metadata.un.org/sdg/10","display_name":"Reduced inequalities"}],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":18,"referenced_works":["https://openalex.org/W1965612834","https://openalex.org/W1996195892","https://openalex.org/W2003484100","https://openalex.org/W2007151696","https://openalex.org/W2011877643","https://openalex.org/W2012411921","https://openalex.org/W2022006134","https://openalex.org/W2052226480","https://openalex.org/W2058454305","https://openalex.org/W2064342065","https://openalex.org/W2074681440","https://openalex.org/W2084169316","https://openalex.org/W2118270242","https://openalex.org/W2123478215","https://openalex.org/W2202358831","https://openalex.org/W2322193123","https://openalex.org/W2322817075","https://openalex.org/W4254821377"],"related_works":["https://openalex.org/W2047610499","https://openalex.org/W2387140374","https://openalex.org/W2073566205","https://openalex.org/W2437021460","https://openalex.org/W2429686810","https://openalex.org/W3025059132","https://openalex.org/W2005543050","https://openalex.org/W2371059786","https://openalex.org/W2065909067","https://openalex.org/W2908982131"],"abstract_inverted_index":null,"counts_by_year":[{"year":2020,"cited_by_count":1},{"year":2019,"cited_by_count":1},{"year":2016,"cited_by_count":2}],"updated_date":"2025-11-06T03:46:38.306776","created_date":"2025-10-10T00:00:00"}
