Computation of the binding affinities of catechol-O-methyltransferase inhibitors: multisubstate relative free energy calculations.
['P. Nuno Palma', 'Maria João Bonifácio', 'Ana I. Loureiro', 'Patrício Soares-da-Silva']
Computation of the binding affinities of catechol-O-methyltransferase inhibitors: multisubstate relative free energy calculations.