Relative Ligand-Binding Free Energies Calculated from Multiple Short QM/MM MD Simulations

Steinmann, Casper (PI (principal investigator))

1 Tidsskriftartikel

1 resultater

2018
Relative Ligand-Binding Free Energies Calculated from Multiple Short QM/MM MD Simulations
Svendsen, C. S., Olsson, M. & Ryde, U., 17 maj 2018, I: Journal of Chemical Theory and Computation. 14, 6, s. 3228–3237 10 s.
Publikation: Bidrag til tidsskrift › Tidsskriftartikel › Forskning › peer review

Åben adgang
Fil
22 Citationer (Scopus)

194 Downloads (Pure)