LongBondEliminator: A Molecular Simulation Tool to Remove Ring Penetrations in Biomolecular Simulation Systems.

Sarkar, Daipayan; Kulke, Martin; Vermaas, Josh V

Sarkar, Daipayan; Kulke, Martin; Vermaas, Josh V.

Afiliação

Sarkar D; MSU-DOE Plant Research Laboratory and Department of Biochemistry and Molecular Biology, Michigan State University, East Lansing, MI 48824, USA.
Kulke M; MSU-DOE Plant Research Laboratory and Department of Biochemistry and Molecular Biology, Michigan State University, East Lansing, MI 48824, USA.
Vermaas JV; MSU-DOE Plant Research Laboratory and Department of Biochemistry and Molecular Biology, Michigan State University, East Lansing, MI 48824, USA.

Biomolecules ; 13(1)2023 01 05.

Article em En | MEDLINE | ID: mdl-36671493

Assuntos

Simulação de Dinâmica Molecular; Conformação Molecular

Palavras-chave

lignin; minimization; molecular simulation; protein glycosylation; ring penetration; virus

Texto completo

Imprimir

XML

PubMed Links

Buscar no Google

Texto completo: 1 Base de dados: MEDLINE Assunto principal: Simulação de Dinâmica Molecular Idioma: En Revista: Biomolecules Ano de publicação: 2023 Tipo de documento: Article País de afiliação: Estados Unidos

Texto completo

Imprimir

XML

PubMed Links

Buscar no Google