{"id":"https://openalex.org/W4229782076","doi":"https://doi.org/10.1109/wsc.2012.6465268","title":"Refactoring and automated performance tuning of computational chemistry application codes","display_name":"Refactoring and automated performance tuning of computational chemistry application codes","publication_year":2012,"publication_date":"2012-12-01","ids":{"openalex":"https://openalex.org/W4229782076","doi":"https://doi.org/10.1109/wsc.2012.6465268"},"language":"en","primary_location":{"id":"doi:10.1109/wsc.2012.6465268","is_oa":false,"landing_page_url":"https://doi.org/10.1109/wsc.2012.6465268","pdf_url":null,"source":{"id":"https://openalex.org/S4363608782","display_name":"Proceedings Title: Proceedings of the 2012 Winter Simulation Conference (WSC)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"conference"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Proceedings Title: Proceedings of the 2012 Winter Simulation Conference (WSC)","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/A5050347720","display_name":"Shirley M. Moore","orcid":"https://orcid.org/0000-0003-2712-6896"},"institutions":[{"id":"https://openalex.org/I164936912","display_name":"The University of Texas at El Paso","ror":"https://ror.org/04d5vba33","country_code":"US","type":"education","lineage":["https://openalex.org/I164936912"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Shirley Moore","raw_affiliation_strings":["University of Texas at El Paso, El Paso, TX, USA"],"affiliations":[{"raw_affiliation_string":"University of Texas at El Paso, El Paso, TX, USA","institution_ids":["https://openalex.org/I164936912"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5050347720"],"corresponding_institution_ids":["https://openalex.org/I164936912"],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":{"value":0.51449275,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"3","issue":null,"first_page":"1","last_page":"9"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10054","display_name":"Parallel Computing and Optimization Techniques","score":0.9965000152587891,"subfield":{"id":"https://openalex.org/subfields/1708","display_name":"Hardware and Architecture"},"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/T10054","display_name":"Parallel Computing and Optimization Techniques","score":0.9965000152587891,"subfield":{"id":"https://openalex.org/subfields/1708","display_name":"Hardware and Architecture"},"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/T11181","display_name":"Advanced Data Storage Technologies","score":0.9940000176429749,"subfield":{"id":"https://openalex.org/subfields/1705","display_name":"Computer Networks and Communications"},"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/T11269","display_name":"Algorithms and Data Compression","score":0.982200026512146,"subfield":{"id":"https://openalex.org/subfields/1702","display_name":"Artificial Intelligence"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/code-refactoring","display_name":"Code refactoring","score":0.9535356760025024},{"id":"https://openalex.org/keywords/porting","display_name":"Porting","score":0.8365254402160645},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.8350462913513184},{"id":"https://openalex.org/keywords/supercomputer","display_name":"Supercomputer","score":0.6381566524505615},{"id":"https://openalex.org/keywords/multi-core-processor","display_name":"Multi-core processor","score":0.48896801471710205},{"id":"https://openalex.org/keywords/profiling","display_name":"Profiling (computer programming)","score":0.48020467162132263},{"id":"https://openalex.org/keywords/many-core","display_name":"Many core","score":0.4176151752471924},{"id":"https://openalex.org/keywords/parallel-computing","display_name":"Parallel computing","score":0.40880680084228516},{"id":"https://openalex.org/keywords/computer-architecture","display_name":"Computer architecture","score":0.3672860264778137},{"id":"https://openalex.org/keywords/software","display_name":"Software","score":0.24466529488563538},{"id":"https://openalex.org/keywords/programming-language","display_name":"Programming language","score":0.19430196285247803}],"concepts":[{"id":"https://openalex.org/C152752567","wikidata":"https://www.wikidata.org/wiki/Q116877","display_name":"Code refactoring","level":3,"score":0.9535356760025024},{"id":"https://openalex.org/C106251023","wikidata":"https://www.wikidata.org/wiki/Q851989","display_name":"Porting","level":3,"score":0.8365254402160645},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.8350462913513184},{"id":"https://openalex.org/C83283714","wikidata":"https://www.wikidata.org/wiki/Q121117","display_name":"Supercomputer","level":2,"score":0.6381566524505615},{"id":"https://openalex.org/C78766204","wikidata":"https://www.wikidata.org/wiki/Q555032","display_name":"Multi-core processor","level":2,"score":0.48896801471710205},{"id":"https://openalex.org/C187191949","wikidata":"https://www.wikidata.org/wiki/Q1138496","display_name":"Profiling (computer programming)","level":2,"score":0.48020467162132263},{"id":"https://openalex.org/C3020431745","wikidata":"https://www.wikidata.org/wiki/Q25325220","display_name":"Many core","level":2,"score":0.4176151752471924},{"id":"https://openalex.org/C173608175","wikidata":"https://www.wikidata.org/wiki/Q232661","display_name":"Parallel computing","level":1,"score":0.40880680084228516},{"id":"https://openalex.org/C118524514","wikidata":"https://www.wikidata.org/wiki/Q173212","display_name":"Computer architecture","level":1,"score":0.3672860264778137},{"id":"https://openalex.org/C2777904410","wikidata":"https://www.wikidata.org/wiki/Q7397","display_name":"Software","level":2,"score":0.24466529488563538},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.19430196285247803}],"mesh":[],"locations_count":2,"locations":[{"id":"doi:10.1109/wsc.2012.6465268","is_oa":false,"landing_page_url":"https://doi.org/10.1109/wsc.2012.6465268","pdf_url":null,"source":{"id":"https://openalex.org/S4363608782","display_name":"Proceedings Title: Proceedings of the 2012 Winter Simulation Conference (WSC)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"conference"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Proceedings Title: Proceedings of the 2012 Winter Simulation Conference (WSC)","raw_type":"proceedings-article"},{"id":"pmh:oai:CiteSeerX.psu:10.1.1.416.5650","is_oa":false,"landing_page_url":"http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.416.5650","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"http://www.informs-sim.org/wsc12papers/includes/files/inv211.pdf","raw_type":"text"}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[],"funders":[{"id":"https://openalex.org/F4320333121","display_name":"University of Texas at El Paso","ror":"https://ror.org/04d5vba33"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":22,"referenced_works":["https://openalex.org/W204746936","https://openalex.org/W1525215176","https://openalex.org/W1985212850","https://openalex.org/W1996887196","https://openalex.org/W2011540334","https://openalex.org/W2022950330","https://openalex.org/W2038509324","https://openalex.org/W2043218878","https://openalex.org/W2064541493","https://openalex.org/W2072196382","https://openalex.org/W2075092012","https://openalex.org/W2098192807","https://openalex.org/W2122002474","https://openalex.org/W2125955291","https://openalex.org/W2136440628","https://openalex.org/W2139397284","https://openalex.org/W2142850739","https://openalex.org/W2153887189","https://openalex.org/W4232325821","https://openalex.org/W6608314662","https://openalex.org/W6631421361","https://openalex.org/W6678686329"],"related_works":["https://openalex.org/W2717174904","https://openalex.org/W2548545698","https://openalex.org/W2092936829","https://openalex.org/W4255057712","https://openalex.org/W4251458280","https://openalex.org/W1582746211","https://openalex.org/W2512412909","https://openalex.org/W1547865754","https://openalex.org/W2126398188","https://openalex.org/W2116570023"],"abstract_inverted_index":{"Computational":[0],"chemistry":[1],"codes":[2,36,48],"such":[3],"as":[4],"GAMESS":[5,135],"and":[6,15,23,75,98,107,134,136,146],"MPQC":[7,133],"have":[8],"been":[9],"under":[10],"development":[11],"for":[12,86,101,113],"several":[13],"years":[14],"are":[16],"constantly":[17],"evolving":[18],"to":[19,25,40,45,54,65,77,131,141],"include":[20],"new":[21,26],"science":[22],"adapt":[24],"high":[27],"performance":[28,61,73,88,103,143],"computing":[29],"(HPC)":[30],"systems.":[31],"Our":[32],"work":[33],"with":[34],"these":[35],"has":[37,59],"given":[38],"rise":[39],"two":[41],"needs.":[42],"One":[43],"is":[44,52,85],"refactor":[46],"the":[47,92,110],"so":[49],"that":[50],"it":[51],"easier":[53],"optimize":[55],"them.":[56],"After":[57],"profiling":[58],"identified":[60],"critical":[62],"regions,":[63],"refactoring":[64,129],"outline":[66],"those":[67],"regions":[68],"into":[69],"separate":[70],"routines":[71],"facilitates":[72],"tuning":[74,102],"porting":[76],"complex":[78,105],"heterogeneous":[79],"HPC":[80],"architectures.":[81,148],"The":[82],"second":[83],"need":[84],"automated":[87,139],"tuning.":[89],"Because":[90],"of":[91,95,117],"large":[93],"number":[94],"both":[96],"fine-grained":[97],"coarse-grained":[99],"parameters":[100,118],"on":[104,127,137,144],"hierarchical":[106],"hybrid":[108],"architectures,":[109],"search":[111],"space":[112],"an":[114],"optimal":[115],"set":[116],"becomes":[119],"very":[120],"large.":[121],"This":[122],"paper":[123],"describes":[124],"initial":[125],"results":[126],"using":[128,138],"tools":[130,140],"restructure":[132],"tune":[142],"multicore":[145],"manycore":[147],"1":[149]},"counts_by_year":[],"updated_date":"2025-11-06T03:46:38.306776","created_date":"2025-10-10T00:00:00"}
