New Patchy Particle Model with Anisotropic Patches for Molecular Dynamics Simulations: Application to a Coarse-Grained Model of Cellulose Nanocrystal.

Rolland, Nicolas; Mehandzhiyski, Aleksandar Y; Garg, Mohit; Linares, Mathieu; Zozoulenko, Igor V

Rolland, Nicolas; Mehandzhiyski, Aleksandar Y; Garg, Mohit; Linares, Mathieu; Zozoulenko, Igor V.

Afiliação

Rolland N; Laboratory of Organic Electronics, ITN, Linköping University, SE-601 74 Norrköping, Sweden.
Mehandzhiyski AY; Laboratory of Organic Electronics, ITN, Linköping University, SE-601 74 Norrköping, Sweden.
Garg M; Laboratory of Organic Electronics, ITN, Linköping University, SE-601 74 Norrköping, Sweden.
Linares M; Laboratory of Organic Electronics, ITN, Linköping University, SE-601 74 Norrköping, Sweden.
Zozoulenko IV; Scientific Visualization Group, ITN, Linköping University, SE-601 74 Norrköping, Sweden.

J Chem Theory Comput ; 16(6): 3699-3711, 2020 Jun 09.

Article em En | MEDLINE | ID: mdl-32403923

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Texto completo: 1 Base de dados: MEDLINE Idioma: En Revista: J Chem Theory Comput Ano de publicação: 2020 Tipo de documento: Article País de afiliação: Suécia

Texto completo

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XML

PubMed Links

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Texto completo: 1 Base de dados: MEDLINE Idioma: En Revista: J Chem Theory Comput Ano de publicação: 2020 Tipo de documento: Article País de afiliação: Suécia