[gmx-users] How can i specify a user defined potential between i, i+2 residues

2012-05-15 Thread mohan maruthi sena
Hi all, I use a user defined potential to describe non-bonded interactions, as this excludes i, i+2,i+3. If i want to describe a user defined potential for i,i+2,i+3,(i.e, 1-2,1-3) residues , how can i give that in mdp file. T -- gmx-users mailing list

Re: [gmx-users] How can i specify a user defined potential between i, i+2 residues

2012-05-15 Thread Mark Abraham
On 16/05/2012 3:43 PM, mohan maruthi sena wrote: Hi all, I use a user defined potential to describe non-bonded interactions, as this excludes i, i+2,i+3. If i want to describe a user defined potential for i,i+2,i+3,(i.e, 1-2,1-3) residues , how can i give that in mdp file. Doing