The description of electronic processes inside proteins from Car-Parrinello molecular dynamics: Chemical transformations

Wiley Interdisciplinary Reviews: Computational Molecular Science

Volumn 3, Issue 4, 2013, Pages 393-407

  Rovira, Carme ^a,b  

^a UNIVERSITY OF BARCELONA   (Spain)

^b INSTITUCIÓ CATALANA DE RECERCA I ESTUDIS AVANÇATS ICREA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

BIOLOGICAL PROBLEMS; CAR-PARRINELLO MOLECULAR DYNAMICS; CHEMICAL TRANSFORMATIONS; ELECTRONIC PROCESS; ENZYMATIC REACTION; METADYNAMICS; QUANTUM CHEMICAL; STRUCTURAL BIOLOGY;

MOLECULAR DYNAMICS; PROTEINS; QUANTUM CHEMISTRY; REACTION KINETICS; SUPERCOMPUTERS;

PROBLEM SOLVING;

EID: 84879093060     PISSN: 17590876     EISSN: 17590884     Source Type: Journal    
DOI: 10.1002/wcms.1153     Document Type: Article

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