Re: SV: [gmx-users] Grompp error in 4.x regarding dihedral multiplicity

Sarah Witzke wrote: Hi again, Thank you very much for your reply Mark. Now, I have a dihedral with the following form: 22232425 1 0.0 7.471 22232425 1 0.0 3.9 2 22232425 1 180.0 1.1 3 222

SV: [gmx-users] Grompp error in 4.x regarding dihedral multiplicity

Hi again, Thank you very much for your reply Mark. Now, I have a dihedral with the following form: 22232425 1 0.0 7.471 22232425 1 0.0 3.9 2 22232425 1 180.0 1.1 3 22232425 1

Re: [gmx-users] Grompp error in 4.x regarding dihedral multiplicity

Sarah Witzke wrote: Dear gromacs users, I'm doing simulations of small molecules in lipid bilayers. Doing the simulations with a DMPC bilayer works fine for all 4.x versions of gromacs. But when I try to do an energy minimization of a POPC bilayer, grompp gives the following error: /people/d

[gmx-users] Grompp error in 4.x regarding dihedral multiplicity

Dear gromacs users, I'm doing simulations of small molecules in lipid bilayers. Doing the simulations with a DMPC bilayer works fine for all 4.x versions of gromacs. But when I try to do an energy minimization of a POPC bilayer, grompp gives the following error: /people/disk2/sarah/gromacs-4.0