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FreeSolv (Free Solvation)

홈페이지 · 논문 24편

The FreeSolv database offers a curated collection of experimental and calculated hydration-free energies for small molecules in water. It includes both experimental values obtained from prior literature and calculated values based on simulations. The goal is to provide accurate hydration-free energy data, which is essential for understanding solvation properties and interactions of molecules in aqueous environments.

벤치마크

Molecular Property Prediction on FreeSolv 결과 46개
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