A Novel Physics-Based Ensemble Modelling Approach That Utilizes Crystal Packing to Predict Aqueous Thermodynamic Solubility
Acta Crystallographica Section A Foundations and Advances（2021）
关键词
crystal structure prediction,property prediction,aqueous thermodynamic solubility,pharmaceuticals,free energy perturbation
AI 理解论文
溯源树
样例
生成溯源树，研究论文发展脉络
Chat Paper
正在生成论文摘要