(2)计算机辅助分子设计(CAMD,Computer-Aided Molecular Design) 对于一个给定的分离体系,由于有机物种类众多,单靠实验或性质约束方法 从千万种化合物中选出最佳的溶剂...
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JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN 计算机辅助分子设计杂志 ; 计算机辅助分子设计杂
computer aided molecular drug design 计算机辅助药物分子设计
Dauricine was taken as a lead compound and the Q-model information cluster analysis was employed for the computer-aided molecular design.
以蝙蝠葛碱为先导化合物,采用Q型信息群分法,进行计算机辅助系列设计。
Group contribution method can be used not only to estimate the properties of compounds, but also in computer-aided molecular design (CAMD).
利用基团贡献法可预测化合物的性质,还能用于化合物的计算机辅助分子设计(CAMD)。
Computer-aided molecular design (CAMD) is now an uprising subject in medicinal chemistry among which structure-based rational drug design is attracting more and more attention.
计算机辅助药物分子设计近年来已成为新药创制的重要手段。 基于结构的合理药物分子设计则是多学科交互融合和渗透的体现。
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