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Metadynamics As a Tool for Mapping the Conformational and Free-Energy Space of Peptides - The Alanine Dipeptide Case Study
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SYSNO 0351148 Title Metadynamics As a Tool for Mapping the Conformational and Free-Energy Space of Peptides - The Alanine Dipeptide Case Study Author(s) Vymětal, Jiří (UOCHB-X) [610/61] RID, ORCID
Vondrášek, Jiří (UOCHB-X) [610/61] RID, ORCIDSource Title Journal of Physical Chemistry B. Roč. 114, č. 16 (2010), s. 5632-5642. - : American Chemical Society Document Type Článek v odborném periodiku Grant LC512 GA MŠMT - Ministry of Education, Youth and Sports (MEYS) CEZ AV0Z40550506 - UOCHB-X (2005-2011) Language eng Country US Keywords metadynamics * alanine dipeptide * explicit water models Permanent Link http://hdl.handle.net/11104/0006157
Number of the records: 1