subject:"\[gmx\-users\] Error while using forcefield GROMOS 43a1p"

Re: [gmx-users] Error while using forcefield GROMOS 43a1p

2010-11-26 Thread Justin A. Lemkul

Jignesh Patel wrote: Dear Justin, I am trying to do simulation of a system which contains phosphorylated serine using GROMOS 43a1p forcefield. While running pdb2gmx command, I am getting following error. Fatal error: Atom N not found in residue seq.nr . 1 while adding improp

[gmx-users] Error while using forcefield GROMOS 43a1p

2010-11-26 Thread Jignesh Patel

Dear Justin, I am trying to do simulation of a system which contains phosphorylated serine using GROMOS 43a1p forcefield. While running pdb2gmx command, I am getting following error. Fatal error: Atom N not found in residue seq.nr. 1 while adding improper thank you in anticipation. With regards