Lv41
602 积分 2023-11-08 加入
Ligand binding affinity prediction with fusion of graph neural networks and 3D structure-based complex graph
2小时前
已完结
Generic protein–ligand interaction scoring by integrating physical prior knowledge and data augmentation modelling
5天前
已完结
A call for an industry-led initiative to critically assess machine learning for real-world drug discovery
11天前
已完结
The future of machine learning for small-molecule drug discovery will be driven by data
20天前
已完结
A practical guide to machine-learning scoring for structure-based virtual screening
27天前
已完结
Training data composition determines machine learning generalization and biological rule discovery
1个月前
已完结
Training data composition determines machine learning generalization and biological rule discovery
1个月前
已完结
The influence of drug-like concepts on decision-making in medicinal chemistry
1个月前
已完结
Benchmarking AI-powered docking methods from the perspective of virtual screening
2个月前
已完结
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