Lv1
88 积分 2023-07-27 加入
Accelerating multiscale modeling in heterogeneous catalysis
2个月前
已完结
TANGO: direct optimization of constrained synthesizability for generative molecular design
3个月前
已完结
Accurate transition state generation with an object-aware equivariant elementary reaction diffusion model
8个月前
已完结
Chemical reaction networks and opportunities for machine learning
8个月前
已完结
Predicting binding motifs of complex adsorbates using machine learning with a physics-inspired graph representation
8个月前
已完结
Recent advances in the application of machine-learning algorithms to predict adsorption energies
8个月前
已完结
SurFF: a foundation model for surface exposure and morphology across intermetallic crystals
8个月前
已完结
A Review of Automated Workflow Pipelines for Computational Chemists
11个月前
已完结
皖公网安备34019202002308
