Lv7
5000 积分 2021-08-27 加入
A Systematic Survey and Benchmark of Deep Learning for Molecular Property Prediction in the Foundation Model Era
7天前
已完结
Unifying machine learning and interpolation theory via interpolating neural networks
1个月前
已完结
SCUBA-D: a freshly trained diffusion model generates high-quality protein structures
2个月前
已完结
Applications of Artificial Intelligence in Biotech Drug Discovery and Product Development
2个月前
已完结
Benchmark database of accurate (MP2 and CCSD(T) complete basis set limit) interaction energies of small model complexes, DNA base pairs, and amino acid pairs
3个月前
已完结
Toward True DNA Base-Stacking Energies: MP2, CCSD(T), and Complete Basis Set Calculations
3个月前
已完结
Reference Quantum Chemical Calculations on RNA Base Pairs Directly Involving the 2′-OH Group of Ribose
3个月前
已完结
Machine learning interatomic potentials at the centennial crossroads of quantum mechanics
3个月前
已完结
The evolution of machine learning potentials for molecules, reactions and materials
4个月前
已完结
De novo Design of All-atom Biomolecular Interactions with RFdiffusion3
5个月前
已完结
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