Dear Justin Thank you for your previoue reply
I have prepared a .tpr file to run it run Successfully in CPU But when i use the Same .tpr files to run in GPU , It have not run successfully What is reason ? What Command Should I give When I run .tpr file in GPU I Hope it may be mdrun -s input.tpr -testverlet Should i add any more flag ? Also I have different rvdw and Coulomb Cut-offs rlist = 0.9 rcoulomb = 0.9 rvdw = 1.4 The following is error Message The VdW and Coulomb cut-offs are different, whereas the Verlet scheme only supports equal cut-offs For more information and tips for troubleshooting, please check the GROMACS Thanks in ADVANCE -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! * Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
