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38 积分 2024-07-19 加入
A Novel Small Molecule Allosteric Inhibitor of IL-17A from a DNA-Encoded Library
10小时前
待确认
Modelling the binding mode of macrocycles: Docking and conformational sampling
1个月前
已完结
Dynamic Docking of Conformationally Constrained Macrocycles: Methods and Applications
1个月前
已完结
A generative deep learning approach to de novo antibiotic design
1个月前
已完结
Extended-Connectivity Fingerprints
2个月前
已完结
Discovery of BGM1812, a Novel Dual Amylin and Calcitonin Receptor Agonist for Obesity Treatment
3个月前
已完结
PyAutoFEP: An Automated Free Energy Perturbation Workflow for GROMACS Integrating Enhanced Sampling Methods
3个月前
已完结
A decade of machine learning-based predictive models for human pharmacokinetics: Advances and challenges
3个月前
已完结
Insights into the structure of class B GPCRs
4个月前
已完结
Hybrid Co‐Solvent‐Induced High‐Entropy Electrolyte: Regulating of Hydrated Zn2+ Solvation Structures for Excellent Reversibility and Wide Temperature Adaptability
5个月前
已完结
Reduced-Order Modeling with Time-Dependent Bases for PDEs with Stochastic Boundary Conditions
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