Multiscale Estimation of Binding Kinetics Using Brownian Dynamics, Molecular Dynamics and Milestoning.

by Lane W Votapka, Rommie E Amaro
Published 2015-10-01

Bridging scales through multiscale modeling: A case study on Protein Kinase A

by Sophia P Hirakis, Britton Warren Boras, Lane W Votapka, Robert Dean Malmstrom, Robert Dean Malmstrom, Andrew D McCulloch, Andrew D McCulloch, Andrew D McCulloch, Rommie E Amaro, Rommie E Amaro
Published 2015-09-01