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The Properties of Known Drugs. 1. Molecular Frameworks
2天前
已完结
3D-Mol: A Novel Contrastive Learning Framework for Molecular Property Prediction with 3D Information
16天前
已完结
Pushing the Boundaries of Molecular Representation for Drug Discovery with the Graph Attention Mechanism
27天前
已完结
Solubility Challenge: Can You Predict Solubilities of 32 Molecules Using a Database of 100 Reliable Measurements?
27天前
已完结
Machine learning for molecular and materials science
27天前
已完结
The use of characteristic volumes to measure cavity terms in reversed phase liquid chromatography
27天前
已完结
Scales of solute hydrogen-bonding: their construction and application to physicochemical and biochemical processes
27天前
已完结
COSMO-RS: a novel and efficient method for the a priori prediction of thermophysical data of liquids
27天前
已完结
Conductor-like Screening Model for Real Solvents: A New Approach to the Quantitative Calculation of Solvation Phenomena
27天前
已完结
Neural Message Passing for Quantum Chemistry
1个月前
已完结
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