Solvate Suite: Software Updates

Solvate Suite: A Command-Line Interface for Molecular Simulations and Multiscale Microsolvation Modeling

Otávio L. Santana; Daniel G. Silva; Sidney R. Santana

J. Chem. Inf. Model. 2024, 64, 9, 3767–3778


NMR Prediction

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Solvation Free Energy

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Reduction Potentials & pKa

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