- Publication
- Jun 14, 2022
Discovery of a Novel Class of d-Amino Acid Oxidase Inhibitors Using the Schr’dinger Computational Platform
Haifeng Tang, et al. Journal of Medicinal Chemistry, 2022, 65(9), 6775-6802- Publication
- May 19, 2022
Impacting Drug Discovery Projects with Large-Scale Enumerations, Machine Learning Strategies, and Free-Energy Predictions
Jennifer L. Knight, et al. Free Energy Methods in Drug Discovery, 2021, 1397, 205-226- Publication
- May 19, 2022
AutoDesigner, a De Novo Design Algorithm for Rapidly Exploring Large Chemical Space for Lead Optimization: Application to the Design and Synthesis of D-Amino Acid Oxidase Inhibitors
Pieter H. Bos, et al. JCIM, 2022, 62(8), 1905-1915- Publication
- Mar 31, 2021
Efficient Exploration of Chemical Space with Docking and Deep-Learning
Ying Yang, et al. ACS Publications, 2021, 17(11), 7106-7119
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