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668 积分 2023-10-31 加入
Novel Cocrystal Structures of Peptide Antagonists Bound to the Human Melanocortin Receptor 4 Unveil Unexplored Grounds for Structure-Based Drug Design
2小时前
待确认
ConfSolv: Prediction of Solute Conformer-Free Energies across a Range of Solvents
2个月前
已完结
Computing Kinetic Solvent Effects and Liquid Phase Rate Constants Using Quantum Chemistry and COSMO-RS Methods
2个月前
已关闭
When Do Quantum Mechanical Descriptors Help Graph Neural Networks to Predict Chemical Properties?
2个月前
已完结
Exploring Deep Learning of Quantum Chemical Properties for Absorption, Distribution, Metabolism, and Excretion Predictions
3个月前
已完结
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