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38 积分 2023-09-26 加入
Alchemical Transfer Approach to Absolute Binding Free Energy Estimation
11小时前
待确认
Discovery, Structure–Activity Relationship, and Mechanistic Studies of 1-((3R,4S)-3-((Dimethylamino)methyl)-4-hydroxy-4-(3-methoxyphenyl)piperidin-1-yl)-2-(2,4,5-trifluorophenyl)ethan-1-one as a Novel Potent Analgesic
1天前
已完结
Scalable emulation of protein equilibrium ensembles with generative deep learning
7个月前
已完结
Scalable emulation of protein equilibrium ensembles with generative deep learning
7个月前
已完结
Exploring structural diversity across the protein universe with The Encyclopedia of Domains
7个月前
已完结
Lipid Models for United-Atom Molecular Dynamics Simulations of Proteins
11个月前
已完结
Structure of the Nav1.4-β1 Complex from Electric Eel
11个月前
已完结
Atomic-Level Characterization of the Structural Dynamics of Proteins
1年前
已完结
Deactivation Pathway of Ras GTPase Underlies Conformational Substates as Targets for Drug Design
1年前
已完结
Discovery of a Dual Tubulin and Neuropilin-1 (NRP1) Inhibitor with Potent In Vivo Anti-Tumor Activity via Pharmacophore-based Docking Screening, Structure Optimization, and Biological Evaluation
1年前
已完结
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