Lv2
110 积分 2021-08-11 加入
Geometry-enhanced molecular representation learning for property prediction
2年前
已完结
Predicting reaction performance in C–N cross-coupling using machine learning
2年前
已完结
Machine learning made easy for optimizing chemical reactions
2年前
已完结
Mol2Context-vec: learning molecular representation from context awareness for drug discovery
3年前
已完结
Graph neural networks for automated de novo drug design
3年前
已完结
A Comprehensive Survey on Graph Neural Networks
3年前
已完结
Deep learning model for virtual screening of novel 3C-like protease enzyme inhibitors against SARS coronavirus diseases
3年前
已完结
SMILES Pair Encoding: A Data-Driven Substructure Tokenization Algorithm for Deep Learning
3年前
已完结
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