GROMACS Groningen Machine for Chemical Simulations USER MANUAL Version 4.5.4 GROMACS USER MANUAL Version 4.5.4 Written by Emile Apol, Rossen Apostolov, Herman J.C. Berendsen,…
Slide 1Saturday, 02 May 2015 Speeding up HMC with better integrators A D Kennedy and M A Clark School of Physics & SUPA, The University of Edinburgh Boston University…
Speeding up HMC with better integrators A D Kennedy and M A Clark School of Physics & SUPA, The University of Edinburgh Boston University * Abstract We shall discuss…