Re: [gmx-users] list of missing LJ-14 interactions:

On 6/17/13 10:15 AM, 라지브간디 wrote: Dear gmx users, I have simulated the heme protein using gromos43a5 ff. I have used virtual sites2 for the CO ligand and it successfully runs without any error upto equilibrium state ( em, nvt and npt). However,when i start running production for 10 ns and

[gmx-users] list of missing LJ-14 interactions:

Dear gmx users, I have simulated the heme protein using gromos43a5 ff. I have used virtual sites2 for the CO ligand and it successfully runs without any error upto equilibrium state ( em, nvt and npt). However,when i start running production for 10 ns and it stopped step 17400 and shows few