subject:"\[gmx\-users\] Molecule contains no atoms"

Re: [gmx-users] Molecule contains no atoms

2019-09-06 Thread Justin Lemkul

On 9/6/19 11:13 AM, Tanos Franca wrote: Dear users, GROMACS 5.1.4 is returning the error message below after running grompp with stpr.mdp. Does anyone knows how to fix it? Program gmx grompp, VERSION 5.1.4 Source code file: /home/cuda1/Downloads/gromacs-5.1.4/src/gromacs/gmxpreprocess/topio.c

[gmx-users] Molecule contains no atoms

2019-09-06 Thread Tanos Franca

Dear users, GROMACS 5.1.4 is returning the error message below after running grompp with stpr.mdp. Does anyone knows how to fix it? Program gmx grompp, VERSION 5.1.4 Source code file: /home/cuda1/Downloads/gromacs-5.1.4/src/gromacs/gmxpreprocess/topio.c, line: 1001 Fatal error: Molecule type 'MOL