Automated high throughput pK(a) and distribution coefficient measurements of pharmaceutical compounds for the SAMPL8 blind prediction challenge
用于 SAMPL8 盲预测挑战的药物化合物的自动化高通量 pK(a) 和分配系数测量
期刊:Journal of Computer-Aided Molecular Design
影响因子:3.1
doi:10.1007/s10822-021-00427-0
Bahr, Matthew N; Nandkeolyar, Aakankschit; Kenna, John K; Nevins, Neysa; Da Vià, Luigi; Işık, Mehtap; Chodera, John D; Mobley, David L
