Slide 1Molecular activation on hot- surfaces by first principles gloria tabacchi insubria university - Como [email protected] http://scienze-como.uninsubria.it/gloria G…
1. Rachel Miller Research Computing Lab 2. CUDA is a programming language that uses the Graphical Processing Unit (GPU) Allows calculations to be performed in parallel, giving…
ANTON D.E Shaw Research Force Fields: Typical Energy Functions Bond stretches Angle bending Torsional rotation Improper torsion (sp2) Electrostatic interaction Lennard-Jones…
Anton, a Special-Purpose Machine for Molecular Dynamics Simulation By David E. Shaw et al Presented by Bob Koutsoyannis The Anton Legacy Anton van Leeuwenhoek âFather of…