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Deep learning collective variables from transition path ensemble.
Ray, Dhiman; Trizio, Enrico; Parrinello, Michele.
Affiliation
  • Ray D; Atomistic Simulations, Italian Institute of Technology, Via Enrico Melen 83, Genoa GE 16153, Italy.
  • Trizio E; Atomistic Simulations, Italian Institute of Technology, Via Enrico Melen 83, Genoa GE 16153, Italy.
  • Parrinello M; Department of Materials Science, Università di Milano-Bicocca, Milano 20126, Italy.
J Chem Phys ; 158(20)2023 May 28.
Article in En | MEDLINE | ID: mdl-37212403
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Full text: 1 Collection: 01-internacional Database: MEDLINE Type of study: Prognostic_studies Language: En Journal: J Chem Phys Year: 2023 Document type: Article Affiliation country: Italia Country of publication: Estados Unidos
Fulltext
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Full text: 1 Collection: 01-internacional Database: MEDLINE Type of study: Prognostic_studies Language: En Journal: J Chem Phys Year: 2023 Document type: Article Affiliation country: Italia Country of publication: Estados Unidos