{"id":"https://openalex.org/W4416146920","doi":"https://doi.org/10.1145/3712285.3769436","title":"Reproducibility Report for SC25 Paper TensorMD: Accelerating Molecular Dynamics with a High-Performance Machine Learning Interatomic Potential","display_name":"Reproducibility Report for SC25 Paper TensorMD: Accelerating Molecular Dynamics with a High-Performance Machine Learning Interatomic Potential","publication_year":2025,"publication_date":"2025-11-12","ids":{"openalex":"https://openalex.org/W4416146920","doi":"https://doi.org/10.1145/3712285.3769436"},"language":null,"primary_location":{"id":"doi:10.1145/3712285.3769436","is_oa":false,"landing_page_url":"https://doi.org/10.1145/3712285.3769436","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Proceedings of the International Conference for High Performance Computing, Networking, Storage and Analysis","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/A5085737368","display_name":"Minh Thanh Chung","orcid":"https://orcid.org/0000-0001-6119-3852"},"institutions":[{"id":"https://openalex.org/I8204097","display_name":"Ludwig-Maximilians-Universit\u00e4t M\u00fcnchen","ror":"https://ror.org/05591te55","country_code":"DE","type":"education","lineage":["https://openalex.org/I8204097"]},{"id":"https://openalex.org/I4210163716","display_name":"Leibniz Supercomputing Centre","ror":"https://ror.org/05558nw16","country_code":"DE","type":"facility","lineage":["https://openalex.org/I109144446","https://openalex.org/I4210163716"]}],"countries":["DE"],"is_corresponding":true,"raw_author_name":"Minh Chung","raw_affiliation_strings":["Leibniz Supercomputing Centre, Munich, Germany and Institute for Computer Science, Ludwig-Maximilians-University of Munich, Munich, Germany"],"affiliations":[{"raw_affiliation_string":"Leibniz Supercomputing Centre, Munich, Germany and Institute for Computer Science, Ludwig-Maximilians-University of Munich, Munich, Germany","institution_ids":["https://openalex.org/I8204097","https://openalex.org/I4210163716"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5085737368"],"corresponding_institution_ids":["https://openalex.org/I4210163716","https://openalex.org/I8204097"],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":{"value":0.29250675,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":null,"issue":null,"first_page":"2269","last_page":"2270"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11948","display_name":"Machine Learning in Materials Science","score":0.6179999709129333,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T11948","display_name":"Machine Learning in Materials Science","score":0.6179999709129333,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11986","display_name":"Scientific Computing and Data Management","score":0.07609999924898148,"subfield":{"id":"https://openalex.org/subfields/1802","display_name":"Information Systems and Management"},"field":{"id":"https://openalex.org/fields/18","display_name":"Decision Sciences"},"domain":{"id":"https://openalex.org/domains/2","display_name":"Social Sciences"}},{"id":"https://openalex.org/T10857","display_name":"Advanced Electron Microscopy Techniques and Applications","score":0.024299999698996544,"subfield":{"id":"https://openalex.org/subfields/1315","display_name":"Structural 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/reproducibility","display_name":"Reproducibility","score":0.9230999946594238},{"id":"https://openalex.org/keywords/artifact","display_name":"Artifact (error)","score":0.6865000128746033},{"id":"https://openalex.org/keywords/molecular-dynamics","display_name":"Molecular dynamics","score":0.4925999939441681},{"id":"https://openalex.org/keywords/interatomic-potential","display_name":"Interatomic potential","score":0.4587000012397766},{"id":"https://openalex.org/keywords/work","display_name":"Work (physics)","score":0.39259999990463257}],"concepts":[{"id":"https://openalex.org/C9893847","wikidata":"https://www.wikidata.org/wiki/Q1425625","display_name":"Reproducibility","level":2,"score":0.9230999946594238},{"id":"https://openalex.org/C2779010991","wikidata":"https://www.wikidata.org/wiki/Q2720909","display_name":"Artifact (error)","level":2,"score":0.6865000128746033},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.5491999983787537},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.5116999745368958},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.4925999939441681},{"id":"https://openalex.org/C2776372370","wikidata":"https://www.wikidata.org/wiki/Q3399989","display_name":"Interatomic potential","level":3,"score":0.4587000012397766},{"id":"https://openalex.org/C119857082","wikidata":"https://www.wikidata.org/wiki/Q2539","display_name":"Machine learning","level":1,"score":0.4438999891281128},{"id":"https://openalex.org/C18762648","wikidata":"https://www.wikidata.org/wiki/Q42213","display_name":"Work (physics)","level":2,"score":0.39259999990463257},{"id":"https://openalex.org/C145912823","wikidata":"https://www.wikidata.org/wiki/Q113558","display_name":"Dynamics (music)","level":2,"score":0.364300012588501},{"id":"https://openalex.org/C158154518","wikidata":"https://www.wikidata.org/wiki/Q7310970","display_name":"Relevance (law)","level":2,"score":0.23589999973773956}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1145/3712285.3769436","is_oa":false,"landing_page_url":"https://doi.org/10.1145/3712285.3769436","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Proceedings of the International Conference for High Performance Computing, Networking, Storage and Analysis","raw_type":"proceedings-article"}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":0,"referenced_works":[],"related_works":[],"abstract_inverted_index":{"This":[0],"reproducibility":[1],"report":[2],"provides":[3],"details":[4],"about":[5],"the":[6,13,20,46,57],"artifact":[7],"evaluation":[8],"done":[9,42],"with":[10,27],"regard":[11],"to":[12],"Artifact":[14],"Description":[15],"and":[16],"Evaluation":[17],"appendix":[18],"of":[19,45,49,56],"SC25":[21,58],"paper":[22],"TensorMD:":[23],"Accelerating":[24],"Molecular":[25],"Dynamics":[26],"a":[28,54],"High-Performance":[29],"Machine":[30],"Learning":[31],"Interatomic":[32],"Potential":[33],"by":[34],"Rongfen":[35],"Lin":[36],"et":[37],"al.":[38],"The":[39,51],"work":[40],"was":[41],"as":[43],"part":[44],"Reproducibility":[47,59],"Initiative":[48],"SC25.":[50],"author":[52],"is":[53],"member":[55],"Committee.":[60]},"counts_by_year":[],"updated_date":"2026-03-07T16:01:11.037858","created_date":"2025-11-12T00:00:00"}