3 Questions 6 Answers 0 Followers
Questions related from Arjun Wadhawan
Rather basic question for the experts. I have frames from 1.gro, 2.gro .....20.gro in order. I want to join them to a .trr or .xtc file to make a trajectory. How can i do it using gromacs...
24 March 2017 8,485 12 View
My system has Water and a Gas (lennard jones) molecules. I have water crystals (x) . I want to solvate it with liquid water (y) around it. I am using OPLA-AA force field apart from that. Both x...
05 October 2016 8,675 7 View
Attached is the tail of log files from 3 different runs on same system. 1 Node is used to compute using 8, 4 and 1 processor respectively to check the speed I am running an MD simulation on...
26 September 2016 3,146 6 View
