Computational screens can speed up the discovery of pharmaceutical cocrystals

被引：3
作者：
Prohens, Rafel [1 ]
Hunter, Christopher A. [2 ]
机构：
[1] Univ Barcelona, Unitat Polimorfisme & Calorimetria, Centres Cient & Tecnol, Baldiri Reixac 10, E-08028 Barcelona, Spain
[2] Univ Cambridge, Dept Chem, Lensfield Rd, Cambridge CB2 1EW, England
来源：
ADMET AND DMPK | 2018年 / 6卷 / 04期
关键词：
Cocrystals; virtual screen; H-bond parameters;
D O I：
10.5599/admet.641
中图分类号：
R914 [药物化学];
学科分类号：
100701 ;
摘要：
The calculation of Surface Site Interaction Points for cocrystal computational screens in combination with efficient experimental cocrystallization techniques has been applied successfully to several drug compounds. The basics of this combined approach are briefly reviewed in this communication.
引用
收藏
页码：284 / 287
页数：4
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