Site-Specific Fragment Identification Guided by Single-Step Free Energy Perturbation Calculations
Site-Specific Fragment Identification Guided by Single-Step Free Energy Perturbation CalculationsNovember 8, 2016
ssfep publications
Estimation of relative free energies of binding using pre-computed ensembles based on the single-step free energy perturbation and the site-identification by ligand competitive saturation approaches
Estimation of relative free energies of binding using pre-computed ensembles based on the single-step free energy perturbation and the site-identification by ligand competitive saturation approachesNovember 1, 2016