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Janus-QUBO: A Duality-Aware Framework for Navigating Chemical Space with a Tunable Quantum-Inspired Landscape
1个月前
已完结
KAN-based symbolic QSPR modeling for molecular property prediction
1个月前
已完结
TransMagNet: prediction of crystal system and space group for crystalline materials based on composition using deep learning
1个月前
已关闭
Inverse design of nanoporous crystalline reticular materials with deep generative models
1个月前
已完结
Inverse Design of Metal–Organic Polyhedra through Molecular Fragmentation and Evolutionary Optimisation
2个月前
已完结
A graph-based genetic algorithm and generative model/Monte Carlo tree search for the exploration of chemical space
2个月前
已完结
OmeDDG: Improved Protein Mutation Stability Prediction Based on Predicted 3D Structures
3个月前
已完结
MolRWKV: Conditional Molecular Generation Model Using Local Enhancement and Graph Enhancement
3个月前
已完结
Dual-Branch Graph Neural Network for Predicting Molecular Odors and Discovering the Relationship Between Functional Groups and Odors
3个月前
已完结
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