Lv5114
900 积分 2021-03-11 加入
Substructure-Enhanced MPNN for Polymer Discovery and Knowledge: A Study in Predicting Glass Transition Temperature
14天前
已完结
A glimpse inside materials: Polymer structure – Glass transition temperature relationship as observed by a trained artificial intelligence
25天前
已完结
Prediction and Interpretability Study of the Glass Transition Temperature of Polyimide Based on Machine Learning with Quantitative Structure–Property Relationship (Tg-QSPR)
25天前
已完结
Predicting the Glass Transition Temperature of Biopolymers via High-Throughput Molecular Dynamics Simulations and Machine Learning
25天前
已完结
Glass Transition Temperature Prediction of Polymers via Graph Reinforcement Learning
25天前
已完结
Machine learning-aided generative molecular design
25天前
已完结
Directly optimizing for synthesizability in generative molecular design using retrosynthesis models
25天前
已关闭
Deep Generative Models in De Novo Drug Molecule Generation
1个月前
已完结
Recent advances in molecular representation methods and their applications in scaffold hopping
1个月前
已完结
Machine Learning in Polymer Research
1个月前
已完结
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