On 6/17/17 8:55 AM, Sajeewa Pemasinghe wrote:
Hi all,
I have to carry out MD simulations involving PEG 6000 molecules. When I
first build this it is a very long (~480 Angstrom) linear chain. I have the
bond/angle/dihedral parameters for this linear structure. Usually when I
introduce a
Hi all,
I have to carry out MD simulations involving PEG 6000 molecules. When I
first build this it is a very long (~480 Angstrom) linear chain. I have the
bond/angle/dihedral parameters for this linear structure. Usually when I
introduce a non-standard residue, I perform an optimization in
