Dear Gromacs Users,
I used PRODRG server in order to obtain the topology file for my molecule (52
atoms with all hydrogens). However, server generated Gromacs topology which
involves 47 atoms (for PDB file with polar/aromatic hydrogens). Whether I will
use the pdb file with missing 4
Marzinek, Jan wrote:
Dear Gromacs Users,
I used PRODRG server in order to obtain the topology file for my
molecule (52 atoms with all hydrogens). However, server generated
Gromacs topology which involves 47 atoms (for PDB file with
polar/aromatic hydrogens). Whether I will use the pdb
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