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Free Energy Calculations & Binding Affinity Training | MM-PBSA/GBSA, Alchemical FEP/TI, WHAM/PMF, Uncertainty

Compute binding affinities with rigor: MM-PBSA/GBSA, alchemical FEP/TI with soft-core potentials, umbrella sampling/PMF, error bars (BAR/MBAR/bootstraps), and reproducible affinity reports.

NTHRYS >> Services >> Academic Services >> Training Programs >> Bioinformatics Training >> Proteomics, Structural Bioinformatics, Molecular Modeling

Free Energy Calculations & Binding Affinity — Hands-on

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