Re: [gmx-users] gromacs trajctory mmpbsa

Quoting [EMAIL PROTECTED]: > Dear gromacs user, > I would like to perform an MMPBSA calculation of a proetin ligand > complex using a gromacs trajectory, but this is the first time I try to > do it so I have some questions. > Did anybody use the Amber-MM-PBSA script with gromacs trajectory? > I

[gmx-users] gromacs trajctory mmpbsa

Dear gromacs user, I would like to perform an MMPBSA calculation of a proetin ligand complex using a gromacs trajectory, but this is the first time I try to do it so I have some questions. Did anybody use the Amber-MM-PBSA script with gromacs trajectory? I tried to transform the gromacs traj usi