{"id":"https://openalex.org/W2100322656","doi":"https://doi.org/10.1007/978-3-642-22825-4_11","title":"A Conceptual Many Tasks Computing Architecture to Execute Molecular Docking Simulations of a Fully-Flexible Receptor Model","display_name":"A Conceptual Many Tasks Computing Architecture to Execute Molecular Docking Simulations of a Fully-Flexible Receptor Model","publication_year":2011,"publication_date":"2011-01-01","ids":{"openalex":"https://openalex.org/W2100322656","doi":"https://doi.org/10.1007/978-3-642-22825-4_11","mag":"2100322656"},"language":"en","primary_location":{"id":"doi:10.1007/978-3-642-22825-4_11","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-642-22825-4_11","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/A5047789522","display_name":"Renata De Paris","orcid":"https://orcid.org/0000-0002-6662-2182"},"institutions":[{"id":"https://openalex.org/I45643870","display_name":"Pontif\u00edcia Universidade Cat\u00f3lica do Rio Grande do Sul","ror":"https://ror.org/025vmq686","country_code":"BR","type":"education","lineage":["https://openalex.org/I45643870"]}],"countries":["BR"],"is_corresponding":true,"raw_author_name":"Renata De Paris","raw_affiliation_strings":["Programa de P\u00f3s-Gradua\u00e7\u00e3o em Ci\u00eancia da Computa\u00e7\u00e3o, Faculdade de Inform\u00e1tica, PUCRS, Av. Ipiranga, 6681 \u2013 Pr\u00e9dio 32, Sala 602, 90619-900, Porto Alegre, RS, Brasil"],"affiliations":[{"raw_affiliation_string":"Programa de P\u00f3s-Gradua\u00e7\u00e3o em Ci\u00eancia da Computa\u00e7\u00e3o, Faculdade de Inform\u00e1tica, PUCRS, Av. Ipiranga, 6681 \u2013 Pr\u00e9dio 32, Sala 602, 90619-900, Porto Alegre, RS, Brasil","institution_ids":["https://openalex.org/I45643870"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5010787327","display_name":"F\u00e1bio A. Frantz","orcid":"https://orcid.org/0000-0002-0676-9844"},"institutions":[{"id":"https://openalex.org/I45643870","display_name":"Pontif\u00edcia Universidade Cat\u00f3lica do Rio Grande do Sul","ror":"https://ror.org/025vmq686","country_code":"BR","type":"education","lineage":["https://openalex.org/I45643870"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"F\u00e1bio A. Frantz","raw_affiliation_strings":["Programa de P\u00f3s-Gradua\u00e7\u00e3o em Ci\u00eancia da Computa\u00e7\u00e3o, Faculdade de Inform\u00e1tica, PUCRS, Av. Ipiranga, 6681 \u2013 Pr\u00e9dio 32, Sala 602, 90619-900, Porto Alegre, RS, Brasil"],"affiliations":[{"raw_affiliation_string":"Programa de P\u00f3s-Gradua\u00e7\u00e3o em Ci\u00eancia da Computa\u00e7\u00e3o, Faculdade de Inform\u00e1tica, PUCRS, Av. Ipiranga, 6681 \u2013 Pr\u00e9dio 32, Sala 602, 90619-900, Porto Alegre, RS, Brasil","institution_ids":["https://openalex.org/I45643870"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5064713906","display_name":"Osmar Norberto de Souza","orcid":"https://orcid.org/0000-0002-4602-1208"},"institutions":[{"id":"https://openalex.org/I45643870","display_name":"Pontif\u00edcia Universidade Cat\u00f3lica do Rio Grande do Sul","ror":"https://ror.org/025vmq686","country_code":"BR","type":"education","lineage":["https://openalex.org/I45643870"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Osmar Norberto de Souza","raw_affiliation_strings":["Faculdade de Inform\u00e1tica - PUCRS, Avenida Ipiranga, 6681, Pr\u00e9dio 32 - Sala 608, 90619-900, Porto, Alegre-RS, Brazil","Programa de P\u00f3s-Gradua\u00e7\u00e3o em Ci\u00eancia da Computa\u00e7\u00e3o, Faculdade de Inform\u00e1tica, PUCRS, Av. Ipiranga, 6681 \u2013 Pr\u00e9dio 32, Sala 602, 90619-900, Porto Alegre, RS, Brasil"],"affiliations":[{"raw_affiliation_string":"Faculdade de Inform\u00e1tica - PUCRS, Avenida Ipiranga, 6681, Pr\u00e9dio 32 - Sala 608, 90619-900, Porto, Alegre-RS, Brazil","institution_ids":["https://openalex.org/I45643870"]},{"raw_affiliation_string":"Programa de P\u00f3s-Gradua\u00e7\u00e3o em Ci\u00eancia da Computa\u00e7\u00e3o, Faculdade de Inform\u00e1tica, PUCRS, Av. Ipiranga, 6681 \u2013 Pr\u00e9dio 32, Sala 602, 90619-900, Porto Alegre, RS, Brasil","institution_ids":["https://openalex.org/I45643870"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5019215692","display_name":"Duncan D. Ruiz","orcid":"https://orcid.org/0000-0002-4071-3246"},"institutions":[{"id":"https://openalex.org/I45643870","display_name":"Pontif\u00edcia Universidade Cat\u00f3lica do Rio Grande do Sul","ror":"https://ror.org/025vmq686","country_code":"BR","type":"education","lineage":["https://openalex.org/I45643870"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Duncan D. Ruiz","raw_affiliation_strings":["Programa de P\u00f3s-Gradua\u00e7\u00e3o em Ci\u00eancia da Computa\u00e7\u00e3o, Faculdade de Inform\u00e1tica, PUCRS, Av. Ipiranga, 6681 \u2013 Pr\u00e9dio 32, Sala 602, 90619-900, Porto Alegre, RS, Brasil"],"affiliations":[{"raw_affiliation_string":"Programa de P\u00f3s-Gradua\u00e7\u00e3o em Ci\u00eancia da Computa\u00e7\u00e3o, Faculdade de Inform\u00e1tica, PUCRS, Av. Ipiranga, 6681 \u2013 Pr\u00e9dio 32, Sala 602, 90619-900, Porto Alegre, RS, Brasil","institution_ids":["https://openalex.org/I45643870"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":4,"corresponding_author_ids":["https://openalex.org/A5047789522"],"corresponding_institution_ids":["https://openalex.org/I45643870"],"apc_list":{"value":5000,"currency":"EUR","value_usd":5392},"apc_paid":null,"fwci":0.7782,"has_fulltext":false,"cited_by_count":3,"citation_normalized_percentile":{"value":0.74235294,"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":"75","last_page":"78"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9959999918937683,"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":0.9959999918937683,"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/T12534","display_name":"Protein Degradation and Inhibitors","score":0.9936000108718872,"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/T10044","display_name":"Protein Structure and Dynamics","score":0.9861999750137329,"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/computer-science","display_name":"Computer science","score":0.8753074407577515},{"id":"https://openalex.org/keywords/workflow","display_name":"Workflow","score":0.7843543291091919},{"id":"https://openalex.org/keywords/distributed-computing","display_name":"Distributed computing","score":0.626937985420227},{"id":"https://openalex.org/keywords/supercomputer","display_name":"Supercomputer","score":0.5947523713111877},{"id":"https://openalex.org/keywords/docking","display_name":"Docking (animal)","score":0.5602754354476929},{"id":"https://openalex.org/keywords/architecture","display_name":"Architecture","score":0.5070047378540039},{"id":"https://openalex.org/keywords/parallel-computing","display_name":"Parallel computing","score":0.3438377380371094},{"id":"https://openalex.org/keywords/computational-science","display_name":"Computational science","score":0.3329065442085266},{"id":"https://openalex.org/keywords/database","display_name":"Database","score":0.15563109517097473}],"concepts":[{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.8753074407577515},{"id":"https://openalex.org/C177212765","wikidata":"https://www.wikidata.org/wiki/Q627335","display_name":"Workflow","level":2,"score":0.7843543291091919},{"id":"https://openalex.org/C120314980","wikidata":"https://www.wikidata.org/wiki/Q180634","display_name":"Distributed computing","level":1,"score":0.626937985420227},{"id":"https://openalex.org/C83283714","wikidata":"https://www.wikidata.org/wiki/Q121117","display_name":"Supercomputer","level":2,"score":0.5947523713111877},{"id":"https://openalex.org/C41685203","wikidata":"https://www.wikidata.org/wiki/Q1974042","display_name":"Docking (animal)","level":2,"score":0.5602754354476929},{"id":"https://openalex.org/C123657996","wikidata":"https://www.wikidata.org/wiki/Q12271","display_name":"Architecture","level":2,"score":0.5070047378540039},{"id":"https://openalex.org/C173608175","wikidata":"https://www.wikidata.org/wiki/Q232661","display_name":"Parallel computing","level":1,"score":0.3438377380371094},{"id":"https://openalex.org/C459310","wikidata":"https://www.wikidata.org/wiki/Q117801","display_name":"Computational science","level":1,"score":0.3329065442085266},{"id":"https://openalex.org/C77088390","wikidata":"https://www.wikidata.org/wiki/Q8513","display_name":"Database","level":1,"score":0.15563109517097473},{"id":"https://openalex.org/C153349607","wikidata":"https://www.wikidata.org/wiki/Q36649","display_name":"Visual arts","level":1,"score":0.0},{"id":"https://openalex.org/C142362112","wikidata":"https://www.wikidata.org/wiki/Q735","display_name":"Art","level":0,"score":0.0},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.0},{"id":"https://openalex.org/C159110408","wikidata":"https://www.wikidata.org/wiki/Q121176","display_name":"Nursing","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1007/978-3-642-22825-4_11","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-642-22825-4_11","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":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":10,"referenced_works":["https://openalex.org/W1496383788","https://openalex.org/W1978069786","https://openalex.org/W2003127541","https://openalex.org/W2031740815","https://openalex.org/W2085732173","https://openalex.org/W2099521715","https://openalex.org/W2105668062","https://openalex.org/W2148319892","https://openalex.org/W2149302140","https://openalex.org/W2622581388"],"related_works":["https://openalex.org/W2384867379","https://openalex.org/W4400094300","https://openalex.org/W2329539859","https://openalex.org/W2227905990","https://openalex.org/W2765823764","https://openalex.org/W3214280620","https://openalex.org/W1599154403","https://openalex.org/W1582436825","https://openalex.org/W1996803181","https://openalex.org/W2979588510"],"abstract_inverted_index":null,"counts_by_year":[{"year":2018,"cited_by_count":1},{"year":2013,"cited_by_count":1}],"updated_date":"2025-11-06T03:46:38.306776","created_date":"2025-10-10T00:00:00"}
