An Efficient Local Molecular Dynamics Polymerization Simulation Combined with an <i>Ab Initio</i> MO Method.

Xie, Peng; Orimoto, Yuuichi; Aoki, Yuriko

An Efficient Local Molecular Dynamics Polymerization Simulation Combined with an Ab Initio MO Method.

Xie, Peng; Orimoto, Yuuichi; Aoki, Yuriko.

Afiliación

Xie P; Department of Molecular and Material Sciences, Interdisciplinary Graduate School of Engineering Sciences, Kyushu University, 6-1 Kasuga-Park, Fukuoka 816-8580, Japan. ak-x-peng@mms.kyushu-u.ac.jp.
Orimoto Y; Department of Material Sciences, Faculty of Engineering Sciences, Kyushu University, 6-1 Kasuga-Park, Fukuoka 816-8580, Japan. orimoto.yuuichi.727@m.kyushu-u.ac.jp.
Aoki Y; Department of Material Sciences, Faculty of Engineering Sciences, Kyushu University, 6-1 Kasuga-Park, Fukuoka 816-8580, Japan. aoki.yuriko.397@m.kyushu-u.ac.jp.

Materials (Basel) ; 6(3): 870-885, 2013 Mar 06.

Article en En | MEDLINE | ID: mdl-28809345

Palabras clave

elongation method; helix forming; hydrogen bond; molecular dynamics

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Materials (Basel) Año: 2013 Tipo del documento: Article País de afiliación: Japón Pais de publicación: Suiza

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