Lv7
3541 积分 2020-08-27 加入
A comparative study of different docking methodologies to assess the protein–ligand interaction for the E. coli MurB enzyme
5小时前
待确认
An integrated computational approach to identify GC minor groove binders using various molecular docking scoring functions, dynamics simulations and binding free energy calculations
5小时前
待确认
BioProtIS: Streamlining protein-ligand interaction pipeline for analysis in genomic and transcriptomic exploration
5小时前
已完结
SAnDReS 2.0: Development of machine‐learning models to explore the scoring function space
5小时前
已完结
Protein‐Ligand Structure and Affinity Prediction in CASP16 Using a Geometric Deep Learning Ensemble and Flow Matching
6小时前
已完结
Virtual screening: hope, hype, and the fine line in between
14天前
已完结
Structure of human Bloom's syndrome helicase in complex with ADP and duplex DNA
1个月前
已完结
Efficient and accurate large library ligand docking with KarmaDock
1个月前
已完结
Structures of synaptic vesicle protein 2A and 2B bound to anticonvulsants
1个月前
已完结
Interaction-Based Inductive Bias in Graph Neural Networks: Enhancing Protein-Ligand Binding Affinity Predictions From 3D Structures
2个月前
已完结
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