Journal Article FZJ-2023-04691

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A unified framework for machine learning collective variables for enhanced sampling simulations: mlcolvar

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2023
American Institute of Physics Melville, NY

The journal of chemical physics 159(1), 014801 () [10.1063/5.0156343]

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Contributing Institute(s):
  1. Computational Biomedicine (IAS-5)
  2. Computational Biomedicine (INM-9)
Research Program(s):
  1. 5241 - Molecular Information Processing in Cellular Systems (POF4-524) (POF4-524)

Appears in the scientific report 2023
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Medline ; Embargoed OpenAccess ; Clarivate Analytics Master Journal List ; Current Contents - Physical, Chemical and Earth Sciences ; Ebsco Academic Search ; IF < 5 ; JCR ; National-Konsortium ; PubMed Central ; SCOPUS ; Web of Science Core Collection
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 Record created 2023-11-21, last modified 2024-06-25


Published on 2023-07-06. Available in OpenAccess from 2024-07-06.:
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