{"id":"https://openalex.org/W2086817352","doi":"https://doi.org/10.3390/e16010163","title":"Enhanced Sampling in Molecular Dynamics Using Metadynamics, Replica-Exchange, and Temperature-Acceleration","display_name":"Enhanced Sampling in Molecular Dynamics Using Metadynamics, Replica-Exchange, and Temperature-Acceleration","publication_year":2013,"publication_date":"2013-12-27","ids":{"openalex":"https://openalex.org/W2086817352","doi":"https://doi.org/10.3390/e16010163","mag":"2086817352"},"language":"en","primary_location":{"id":"doi:10.3390/e16010163","is_oa":true,"landing_page_url":"https://doi.org/10.3390/e16010163","pdf_url":"https://www.mdpi.com/1099-4300/16/1/163/pdf?version=1424785218","source":{"id":"https://openalex.org/S195231649","display_name":"Entropy","issn_l":"1099-4300","issn":["1099-4300"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310310987","host_organization_name":"Multidisciplinary Digital Publishing Institute","host_organization_lineage":["https://openalex.org/P4310310987"],"host_organization_lineage_names":["Multidisciplinary Digital Publishing Institute"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Entropy","raw_type":"journal-article"},"type":"article","indexed_in":["arxiv","crossref","doaj"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://www.mdpi.com/1099-4300/16/1/163/pdf?version=1424785218","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5038508476","display_name":"Cameron F. Abrams","orcid":"https://orcid.org/0000-0002-1240-0816"},"institutions":[{"id":"https://openalex.org/I72816309","display_name":"Drexel University","ror":"https://ror.org/04bdffz58","country_code":"US","type":"education","lineage":["https://openalex.org/I72816309"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Cameron Abrams","raw_affiliation_strings":["Department of Chemical and Biological Engineering, Drexel University, 3141 Chestnut Street, Philadelphia, PA 19104, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemical and Biological Engineering, Drexel University, 3141 Chestnut Street, Philadelphia, PA 19104, USA","institution_ids":["https://openalex.org/I72816309"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5005340330","display_name":"Giovanni Bussi","orcid":"https://orcid.org/0000-0001-9216-5782"},"institutions":[{"id":"https://openalex.org/I138549579","display_name":"Scuola Internazionale Superiore di Studi Avanzati","ror":"https://ror.org/004fze387","country_code":"IT","type":"education","lineage":["https://openalex.org/I138549579"]},{"id":"https://openalex.org/I72816309","display_name":"Drexel University","ror":"https://ror.org/04bdffz58","country_code":"US","type":"education","lineage":["https://openalex.org/I72816309"]}],"countries":["IT","US"],"is_corresponding":false,"raw_author_name":"Giovanni Bussi","raw_affiliation_strings":["Scuola Internazionale Superiore di Studi Avanzati (SISSA), via Bonomea 265, Trieste 34136, Italy","Drexel University"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Scuola Internazionale Superiore di Studi Avanzati (SISSA), via Bonomea 265, Trieste 34136, Italy","institution_ids":["https://openalex.org/I138549579"]},{"raw_affiliation_string":"Drexel University","institution_ids":["https://openalex.org/I72816309"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":2,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":{"value":2000,"currency":"CHF","value_usd":2165},"apc_paid":{"value":2000,"currency":"CHF","value_usd":2165},"fwci":18.7981,"has_fulltext":true,"cited_by_count":440,"citation_normalized_percentile":{"value":0.99585966,"is_in_top_1_percent":true,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":99,"max":100},"biblio":{"volume":"16","issue":"1","first_page":"163","last_page":"199"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11177","display_name":"Spectroscopy and Quantum Chemical Studies","score":0.9980000257492065,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T11177","display_name":"Spectroscopy and Quantum Chemical Studies","score":0.9980000257492065,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10044","display_name":"Protein Structure and Dynamics","score":0.9962000250816345,"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/T10591","display_name":"Theoretical and Computational Physics","score":0.9898999929428101,"subfield":{"id":"https://openalex.org/subfields/3104","display_name":"Condensed Matter Physics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/metadynamics","display_name":"Metadynamics","score":0.9466778039932251},{"id":"https://openalex.org/keywords/replica","display_name":"Replica","score":0.8266058564186096},{"id":"https://openalex.org/keywords/biasing","display_name":"Biasing","score":0.7460379600524902},{"id":"https://openalex.org/keywords/parallel-tempering","display_name":"Parallel tempering","score":0.6774225234985352},{"id":"https://openalex.org/keywords/statistical-physics","display_name":"Statistical physics","score":0.6453717947006226},{"id":"https://openalex.org/keywords/acceleration","display_name":"Acceleration","score":0.5977516770362854},{"id":"https://openalex.org/keywords/sampling","display_name":"Sampling (signal processing)","score":0.5605731010437012},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.5346948504447937},{"id":"https://openalex.org/keywords/sampling-bias","display_name":"Sampling bias","score":0.534083366394043},{"id":"https://openalex.org/keywords/molecular-dynamics","display_name":"Molecular dynamics","score":0.5116241574287415},{"id":"https://openalex.org/keywords/variable","display_name":"Variable (mathematics)","score":0.47770097851753235},{"id":"https://openalex.org/keywords/physics","display_name":"Physics","score":0.3080076575279236},{"id":"https://openalex.org/keywords/mathematics","display_name":"Mathematics","score":0.1940409541130066},{"id":"https://openalex.org/keywords/artificial-intelligence","display_name":"Artificial intelligence","score":0.19352281093597412},{"id":"https://openalex.org/keywords/voltage","display_name":"Voltage","score":0.1885611116886139},{"id":"https://openalex.org/keywords/statistics","display_name":"Statistics","score":0.15890565514564514},{"id":"https://openalex.org/keywords/markov-chain-monte-carlo","display_name":"Markov chain Monte Carlo","score":0.12933975458145142},{"id":"https://openalex.org/keywords/sample-size-determination","display_name":"Sample size determination","score":0.12241002917289734},{"id":"https://openalex.org/keywords/classical-mechanics","display_name":"Classical mechanics","score":0.12034153938293457},{"id":"https://openalex.org/keywords/quantum-mechanics","display_name":"Quantum mechanics","score":0.08960601687431335},{"id":"https://openalex.org/keywords/detector","display_name":"Detector","score":0.08193773031234741},{"id":"https://openalex.org/keywords/bayesian-probability","display_name":"Bayesian probability","score":0.08070912957191467}],"concepts":[{"id":"https://openalex.org/C62752575","wikidata":"https://www.wikidata.org/wiki/Q6822487","display_name":"Metadynamics","level":3,"score":0.9466778039932251},{"id":"https://openalex.org/C2775937380","wikidata":"https://www.wikidata.org/wiki/Q1232589","display_name":"Replica","level":2,"score":0.8266058564186096},{"id":"https://openalex.org/C20254490","wikidata":"https://www.wikidata.org/wiki/Q719550","display_name":"Biasing","level":3,"score":0.7460379600524902},{"id":"https://openalex.org/C187653413","wikidata":"https://www.wikidata.org/wiki/Q7135015","display_name":"Parallel tempering","level":5,"score":0.6774225234985352},{"id":"https://openalex.org/C121864883","wikidata":"https://www.wikidata.org/wiki/Q677916","display_name":"Statistical physics","level":1,"score":0.6453717947006226},{"id":"https://openalex.org/C117896860","wikidata":"https://www.wikidata.org/wiki/Q11376","display_name":"Acceleration","level":2,"score":0.5977516770362854},{"id":"https://openalex.org/C140779682","wikidata":"https://www.wikidata.org/wiki/Q210868","display_name":"Sampling (signal processing)","level":3,"score":0.5605731010437012},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.5346948504447937},{"id":"https://openalex.org/C75917345","wikidata":"https://www.wikidata.org/wiki/Q2725298","display_name":"Sampling bias","level":3,"score":0.534083366394043},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.5116241574287415},{"id":"https://openalex.org/C182365436","wikidata":"https://www.wikidata.org/wiki/Q50701","display_name":"Variable (mathematics)","level":2,"score":0.47770097851753235},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.3080076575279236},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.1940409541130066},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.19352281093597412},{"id":"https://openalex.org/C165801399","wikidata":"https://www.wikidata.org/wiki/Q25428","display_name":"Voltage","level":2,"score":0.1885611116886139},{"id":"https://openalex.org/C105795698","wikidata":"https://www.wikidata.org/wiki/Q12483","display_name":"Statistics","level":1,"score":0.15890565514564514},{"id":"https://openalex.org/C111350023","wikidata":"https://www.wikidata.org/wiki/Q1191869","display_name":"Markov chain Monte Carlo","level":3,"score":0.12933975458145142},{"id":"https://openalex.org/C129848803","wikidata":"https://www.wikidata.org/wiki/Q2564360","display_name":"Sample size determination","level":2,"score":0.12241002917289734},{"id":"https://openalex.org/C74650414","wikidata":"https://www.wikidata.org/wiki/Q11397","display_name":"Classical mechanics","level":1,"score":0.12034153938293457},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.08960601687431335},{"id":"https://openalex.org/C94915269","wikidata":"https://www.wikidata.org/wiki/Q1834857","display_name":"Detector","level":2,"score":0.08193773031234741},{"id":"https://openalex.org/C107673813","wikidata":"https://www.wikidata.org/wiki/Q812534","display_name":"Bayesian probability","level":2,"score":0.08070912957191467},{"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/C134306372","wikidata":"https://www.wikidata.org/wiki/Q7754","display_name":"Mathematical analysis","level":1,"score":0.0},{"id":"https://openalex.org/C76155785","wikidata":"https://www.wikidata.org/wiki/Q418","display_name":"Telecommunications","level":1,"score":0.0},{"id":"https://openalex.org/C37669827","wikidata":"https://www.wikidata.org/wiki/Q6904703","display_name":"Monte Carlo molecular modeling","level":4,"score":0.0}],"mesh":[],"locations_count":4,"locations":[{"id":"doi:10.3390/e16010163","is_oa":true,"landing_page_url":"https://doi.org/10.3390/e16010163","pdf_url":"https://www.mdpi.com/1099-4300/16/1/163/pdf?version=1424785218","source":{"id":"https://openalex.org/S195231649","display_name":"Entropy","issn_l":"1099-4300","issn":["1099-4300"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310310987","host_organization_name":"Multidisciplinary Digital Publishing Institute","host_organization_lineage":["https://openalex.org/P4310310987"],"host_organization_lineage_names":["Multidisciplinary Digital Publishing Institute"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Entropy","raw_type":"journal-article"},{"id":"pmh:oai:arXiv.org:1401.0387","is_oa":true,"landing_page_url":"http://arxiv.org/abs/1401.0387","pdf_url":"https://arxiv.org/pdf/1401.0387","source":{"id":"https://openalex.org/S4306400194","display_name":"arXiv (Cornell University)","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I205783295","host_organization_name":"Cornell University","host_organization_lineage":["https://openalex.org/I205783295"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"text"},{"id":"pmh:oai:doaj.org/article:83722de07d664b34873aab014ab845b8","is_oa":true,"landing_page_url":"https://doaj.org/article/83722de07d664b34873aab014ab845b8","pdf_url":null,"source":{"id":"https://openalex.org/S4306401280","display_name":"DOAJ (DOAJ: Directory of Open Access Journals)","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":"repository"},"license":"cc-by-sa","license_id":"https://openalex.org/licenses/cc-by-sa","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Entropy, Vol 16, Iss 1, Pp 163-199 (2013)","raw_type":"article"},{"id":"pmh:oai:mdpi.com:/1099-4300/16/1/163/","is_oa":true,"landing_page_url":"https://dx.doi.org/10.3390/e16010163","pdf_url":null,"source":{"id":"https://openalex.org/S4306400947","display_name":"MDPI (MDPI AG)","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I4210097602","host_organization_name":"Multidisciplinary Digital Publishing Institute (Switzerland)","host_organization_lineage":["https://openalex.org/I4210097602"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Entropy; Volume 16; Issue 1; Pages: 163-199","raw_type":"Text"}],"best_oa_location":{"id":"doi:10.3390/e16010163","is_oa":true,"landing_page_url":"https://doi.org/10.3390/e16010163","pdf_url":"https://www.mdpi.com/1099-4300/16/1/163/pdf?version=1424785218","source":{"id":"https://openalex.org/S195231649","display_name":"Entropy","issn_l":"1099-4300","issn":["1099-4300"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310310987","host_organization_name":"Multidisciplinary Digital Publishing Institute","host_organization_lineage":["https://openalex.org/P4310310987"],"host_organization_lineage_names":["Multidisciplinary Digital Publishing Institute"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Entropy","raw_type":"journal-article"},"sustainable_development_goals":[],"awards":[{"id":"https://openalex.org/G70012605","display_name":"PASI: Molecular-Based Multiscale Modeling and Simulation; Montevideo, Uruguay; September 1-14, 2012","funder_award_id":"1124480","funder_id":"https://openalex.org/F4320306076","funder_display_name":"National Science Foundation"},{"id":"https://openalex.org/G7259679704","display_name":null,"funder_award_id":"DMR-1207389","funder_id":"https://openalex.org/F4320337367","funder_display_name":"Division of Materials Research"},{"id":"https://openalex.org/G8466223725","display_name":"Collaborative Research: On-The-Fly free Energy Parameterization in Molecular Aimulations","funder_award_id":"1207389","funder_id":"https://openalex.org/F4320306076","funder_display_name":"National Science Foundation"}],"funders":[{"id":"https://openalex.org/F4320306076","display_name":"National Science Foundation","ror":"https://ror.org/021nxhr62"},{"id":"https://openalex.org/F4320332161","display_name":"National Institutes of Health","ror":"https://ror.org/01cwqze88"},{"id":"https://openalex.org/F4320337367","display_name":"Division of Materials Research","ror":"https://ror.org/01pc7k308"},{"id":"https://openalex.org/F4320337370","display_name":"Office of International Science and Engineering","ror":"https://ror.org/01k638r21"}],"has_content":{"grobid_xml":true,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W2086817352.pdf","grobid_xml":"https://content.openalex.org/works/W2086817352.grobid-xml"},"referenced_works_count":267,"referenced_works":["https://openalex.org/W301378022","https://openalex.org/W1496727523","https://openalex.org/W1963669000","https://openalex.org/W1964036699","https://openalex.org/W1964217341","https://openalex.org/W1966078827","https://openalex.org/W1967465549","https://openalex.org/W1969486998","https://openalex.org/W1970034345","https://openalex.org/W1970141588","https://openalex.org/W1970900907","https://openalex.org/W1970973025","https://openalex.org/W1971290752","https://openalex.org/W1971724949","https://openalex.org/W1972594892","https://openalex.org/W1973016225","https://openalex.org/W1973344398","https://openalex.org/W1973987921","https://openalex.org/W1977569451","https://openalex.org/W1978688326","https://openalex.org/W1978842465","https://openalex.org/W1979860914","https://openalex.org/W1980782498","https://openalex.org/W1982092510","https://openalex.org/W1983423577","https://openalex.org/W1983628095","https://openalex.org/W1984481443","https://openalex.org/W1984905809","https://openalex.org/W1984942356","https://openalex.org/W1986614779","https://openalex.org/W1986986500","https://openalex.org/W1988102903","https://openalex.org/W1988159335","https://openalex.org/W1988751423","https://openalex.org/W1989096170","https://openalex.org/W1989906072","https://openalex.org/W1989929786","https://openalex.org/W1990408635","https://openalex.org/W1990585732","https://openalex.org/W1991329443","https://openalex.org/W1991752526","https://openalex.org/W1992134468","https://openalex.org/W1993177346","https://openalex.org/W1993741478","https://openalex.org/W1993883578","https://openalex.org/W1994012733","https://openalex.org/W1994295630","https://openalex.org/W1995907662","https://openalex.org/W1998262571","https://openalex.org/W1998404217","https://openalex.org/W1998482337","https://openalex.org/W1999152484","https://openalex.org/W1999283300","https://openalex.org/W1999372352","https://openalex.org/W2000545830","https://openalex.org/W2001425282","https://openalex.org/W2001996470","https://openalex.org/W2002914903","https://openalex.org/W2003240840","https://openalex.org/W2005632053","https://openalex.org/W2007230762","https://openalex.org/W2007655623","https://openalex.org/W2009966648","https://openalex.org/W2013691770","https://openalex.org/W2013829952","https://openalex.org/W2013880394","https://openalex.org/W2014574246","https://openalex.org/W2016331581","https://openalex.org/W2016576837","https://openalex.org/W2018133560","https://openalex.org/W2018423148","https://openalex.org/W2019266755","https://openalex.org/W2019287091","https://openalex.org/W2019465613","https://openalex.org/W2021858530","https://openalex.org/W2023256284","https://openalex.org/W2023472866","https://openalex.org/W2023980306","https://openalex.org/W2024060531","https://openalex.org/W2024304474","https://openalex.org/W2024400312","https://openalex.org/W2024454597","https://openalex.org/W2024815910","https://openalex.org/W2024816860","https://openalex.org/W2024961167","https://openalex.org/W2026002205","https://openalex.org/W2028174524","https://openalex.org/W2028875836","https://openalex.org/W2029186981","https://openalex.org/W2030718037","https://openalex.org/W2031482931","https://openalex.org/W2031484273","https://openalex.org/W2032961028","https://openalex.org/W2033477384","https://openalex.org/W2033513797","https://openalex.org/W2033858596","https://openalex.org/W2035114470","https://openalex.org/W2035558816","https://openalex.org/W2035956174","https://openalex.org/W2040809566","https://openalex.org/W2041137540","https://openalex.org/W2041652966","https://openalex.org/W2041694664","https://openalex.org/W2041753261","https://openalex.org/W2042741906","https://openalex.org/W2042821667","https://openalex.org/W2043243516","https://openalex.org/W2043429268","https://openalex.org/W2043710248","https://openalex.org/W2044150039","https://openalex.org/W2044451931","https://openalex.org/W2046966843","https://openalex.org/W2047878582","https://openalex.org/W2049738344","https://openalex.org/W2049916329","https://openalex.org/W2049970488","https://openalex.org/W2050013509","https://openalex.org/W2051460135","https://openalex.org/W2051532262","https://openalex.org/W2051629080","https://openalex.org/W2052194343","https://openalex.org/W2052735470","https://openalex.org/W2054713699","https://openalex.org/W2055486715","https://openalex.org/W2055648985","https://openalex.org/W2057806291","https://openalex.org/W2057945291","https://openalex.org/W2058693904","https://openalex.org/W2058740965","https://openalex.org/W2058754926","https://openalex.org/W2058971275","https://openalex.org/W2059906977","https://openalex.org/W2060361607","https://openalex.org/W2062393760","https://openalex.org/W2062602712","https://openalex.org/W2064817605","https://openalex.org/W2065176466","https://openalex.org/W2065212461","https://openalex.org/W2065372326","https://openalex.org/W2065888395","https://openalex.org/W2065908318","https://openalex.org/W2067567688","https://openalex.org/W2068055627","https://openalex.org/W2068739250","https://openalex.org/W2069982778","https://openalex.org/W2071360373","https://openalex.org/W2071963550","https://openalex.org/W2074083594","https://openalex.org/W2074225530","https://openalex.org/W2074269844","https://openalex.org/W2077412035","https://openalex.org/W2079134867","https://openalex.org/W2079686838","https://openalex.org/W2080618717","https://openalex.org/W2080740138","https://openalex.org/W2081894427","https://openalex.org/W2082179063","https://openalex.org/W2082916499","https://openalex.org/W2083544350","https://openalex.org/W2084868211","https://openalex.org/W2086807085","https://openalex.org/W2087484384","https://openalex.org/W2088627451","https://openalex.org/W2090427179","https://openalex.org/W2091283009","https://openalex.org/W2094389811","https://openalex.org/W2094944141","https://openalex.org/W2099821681","https://openalex.org/W2100627460","https://openalex.org/W2102853104","https://openalex.org/W2105277973","https://openalex.org/W2108640116","https://openalex.org/W2108651330","https://openalex.org/W2109264135","https://openalex.org/W2109769343","https://openalex.org/W2110343245","https://openalex.org/W2112133710","https://openalex.org/W2112154906","https://openalex.org/W2114871137","https://openalex.org/W2116166262","https://openalex.org/W2116999379","https://openalex.org/W2118233996","https://openalex.org/W2119546621","https://openalex.org/W2119617853","https://openalex.org/W2121138440","https://openalex.org/W2121807492","https://openalex.org/W2122961422","https://openalex.org/W2123891429","https://openalex.org/W2124920204","https://openalex.org/W2128930058","https://openalex.org/W2129213941","https://openalex.org/W2129942459","https://openalex.org/W2130359327","https://openalex.org/W2131370653","https://openalex.org/W2135328202","https://openalex.org/W2135550795","https://openalex.org/W2137948699","https://openalex.org/W2138554443","https://openalex.org/W2139702264","https://openalex.org/W2140850015","https://openalex.org/W2142364749","https://openalex.org/W2143171629","https://openalex.org/W2144426052","https://openalex.org/W2144664237","https://openalex.org/W2144946183","https://openalex.org/W2145009293","https://openalex.org/W2146411229","https://openalex.org/W2146942655","https://openalex.org/W2148450065","https://openalex.org/W2149655632","https://openalex.org/W2150081678","https://openalex.org/W2150532276","https://openalex.org/W2150981663","https://openalex.org/W2151020862","https://openalex.org/W2152644977","https://openalex.org/W2153922255","https://openalex.org/W2155714127","https://openalex.org/W2159923313","https://openalex.org/W2162166182","https://openalex.org/W2163291301","https://openalex.org/W2164957016","https://openalex.org/W2166273895","https://openalex.org/W2169017143","https://openalex.org/W2169493647","https://openalex.org/W2171820635","https://openalex.org/W2314828685","https://openalex.org/W2315221227","https://openalex.org/W2316089164","https://openalex.org/W2318005401","https://openalex.org/W2321474537","https://openalex.org/W2321545372","https://openalex.org/W2322146879","https://openalex.org/W2322595384","https://openalex.org/W2323586060","https://openalex.org/W2324869381","https://openalex.org/W2325423092","https://openalex.org/W2326101186","https://openalex.org/W2328269614","https://openalex.org/W2329292798","https://openalex.org/W2329514750","https://openalex.org/W2331820269","https://openalex.org/W2333054591","https://openalex.org/W2334105485","https://openalex.org/W2334169160","https://openalex.org/W2335054826","https://openalex.org/W2614386918","https://openalex.org/W2792143480","https://openalex.org/W2911645444","https://openalex.org/W2949132629","https://openalex.org/W3037896947","https://openalex.org/W3098696145","https://openalex.org/W3099123759","https://openalex.org/W3101283494","https://openalex.org/W3101760009","https://openalex.org/W3102987216","https://openalex.org/W3104163644","https://openalex.org/W3105197180","https://openalex.org/W3105901899","https://openalex.org/W3106241934","https://openalex.org/W3166425995","https://openalex.org/W4240483627","https://openalex.org/W4241624201","https://openalex.org/W4245001377","https://openalex.org/W4250446469","https://openalex.org/W4255584963","https://openalex.org/W4302810724","https://openalex.org/W6637760386"],"related_works":["https://openalex.org/W4243396746","https://openalex.org/W1992999387","https://openalex.org/W2967656224","https://openalex.org/W2038572295","https://openalex.org/W2023834897","https://openalex.org/W2011608718","https://openalex.org/W3100225272","https://openalex.org/W2034923502","https://openalex.org/W4376867757","https://openalex.org/W2086817352"],"abstract_inverted_index":{"We":[0,14,57,71,79],"review":[1],"a":[2,82],"selection":[3],"of":[4,85],"methods":[5,16,38,61],"for":[6],"performing":[7],"enhanced":[8],"sampling":[9,68],"in":[10],"molecular":[11],"dynamics":[12],"simulations.":[13],"consider":[15,73],"based":[17],"on":[18,23],"collective":[19],"variable":[20],"biasing":[21,51],"and":[22,25,29,54,69,76],"tempering,":[24],"offer":[26],"both":[27],"historical":[28],"contemporary":[30],"perspectives.":[31],"In":[32],"collective-variable":[33],"biasing,":[34,47],"we":[35],"first":[36],"discuss":[37],"stemming":[39],"from":[40],"thermodynamic":[41],"integration":[42],"that":[43,62],"use":[44,63],"mean":[45],"force":[46,52],"including":[48,66],"the":[49],"adaptive":[50],"algorithm":[53],"temperature":[55],"acceleration.":[56],"then":[58],"turn":[59],"to":[60],"bias":[64],"potentials,":[65],"umbrella":[67],"metadynamics.":[70],"next":[72],"parallel":[74],"tempering":[75],"replica-exchange":[77],"methods.":[78,88],"conclude":[80],"with":[81],"brief":[83],"presentation":[84],"some":[86],"combination":[87]},"counts_by_year":[{"year":2026,"cited_by_count":8},{"year":2025,"cited_by_count":25},{"year":2024,"cited_by_count":22},{"year":2023,"cited_by_count":38},{"year":2022,"cited_by_count":48},{"year":2021,"cited_by_count":39},{"year":2020,"cited_by_count":53},{"year":2019,"cited_by_count":33},{"year":2018,"cited_by_count":50},{"year":2017,"cited_by_count":39},{"year":2016,"cited_by_count":38},{"year":2015,"cited_by_count":36},{"year":2014,"cited_by_count":11}],"updated_date":"2026-06-17T08:01:34.144755","created_date":"2016-06-24T00:00:00"}
