Lv1
20 积分 2023-11-28 加入
Robust generative transition-state models for unseen chemistry
1个月前
已完结
Chemistry-informed deep learning model for predicting stereoselectivity and absolute configuration in asymmetric hydrogenation
8个月前
已完结
Chemistry-informed deep learning model for predicting stereoselectivity and absolute configuration in asymmetric hydrogenation
8个月前
已完结
Combining quantum chemistry, machine learning and rate theory for organic luminescent materials
9个月前
已完结
Ab initio molecular dynamics simulation of liquid water with fragment-based quantum mechanical approach under periodic boundary conditions
9个月前
已关闭
Terahertz calorimetry spotlights the role of water in biological processes
1年前
已完结
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