t
the case for me. I checked that the top file was easily created using
the default OPLS-AA (from 2001) in Gromacs 2018.3.
Could anyone help me with that?
Cheers,
Strach
pon., 19 lis 2018 o 18:53 Sla s napisał(a):
> Hi all Gromacs Users,
> I wanted to conduct MD simulations using th
Hi all Gromacs Users,
I wanted to conduct MD simulations using the newest OPLS-AA
force field parameters - OPLS AA/M. I downloaded the folder
with parameters from the main website of the developers
and put it to the GMX top directory. The new ff is recognised,
but while using pdb2gmx to create a
