A relationship between membrane permeation and partitioning of nitroaromatic explosives and their functional groups. A computational study.

Yang, Hong; Li, Huarong; Zhou, Mi; Wei, Tong; Tang, Can; Liu, Liu; Zhou, Yang; Long, Xinping

Yang, Hong; Li, Huarong; Zhou, Mi; Wei, Tong; Tang, Can; Liu, Liu; Zhou, Yang; Long, Xinping.

Afiliação

Yang H; School of Materials Science and Engineering, Tsinghua University, Beijing 100084, China and Institute of Chemical Materials, China Academy of Engineering and Physics, Mianyang 621900, China. zhouy@caep.cn.
Li H; Institute of Chemical Materials, China Academy of Engineering and Physics, Mianyang 621900, China. zhouy@caep.cn.
Zhou M; Institute of Chemical Materials, China Academy of Engineering and Physics, Mianyang 621900, China. zhouy@caep.cn.
Wei T; Institute of Chemical Materials, China Academy of Engineering and Physics, Mianyang 621900, China. zhouy@caep.cn.
Tang C; Institute of Chemical Materials, China Academy of Engineering and Physics, Mianyang 621900, China. zhouy@caep.cn.
Liu L; Institute of Chemical Materials, China Academy of Engineering and Physics, Mianyang 621900, China. zhouy@caep.cn.
Zhou Y; Institute of Chemical Materials, China Academy of Engineering and Physics, Mianyang 621900, China. zhouy@caep.cn.
Long X; Institute of Chemical Materials, China Academy of Engineering and Physics, Mianyang 621900, China. zhouy@caep.cn.

Phys Chem Chem Phys ; 22(16): 8791-8799, 2020 Apr 29.

Article em En | MEDLINE | ID: mdl-32285066

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: Phys Chem Chem Phys Assunto da revista: BIOFISICA / QUIMICA Ano de publicação: 2020 Tipo de documento: Article País de afiliação: China

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