Re: [gmx-users] implicit solvent protein simulations with charmm

2012-08-13 Thread Mark Abraham
On 14/08/2012 1:07 AM, Sai Pooja wrote: Hi, I have read a couple of posts on related topics but I am still not sure how to proceed and would be grateful to get some help. I want to run implicit solvent simulations of a protein+water (implicit) system in the canonical ensemble using charmm27+cma

[gmx-users] implicit solvent protein simulations with charmm

2012-08-13 Thread Sai Pooja
Hi, I have read a couple of posts on related topics but I am still not sure how to proceed and would be grateful to get some help. I want to run implicit solvent simulations of a protein+water (implicit) system in the canonical ensemble using charmm27+cmap forcefield. I am trying to use the param