RE: [gmx-users] Protein jumping out of water box

2010-12-03 Thread Kukol, Andreas
Yes, everyone knows why this happens. This question has been asked so often that there is a FAQ on the Gromacs web-site: http://www.gromacs.org/Documentation/Terminology/Periodic_Boundary_Conditions Best wishes Andreas --- From: gmx-users-boun...@gromacs.org [mailto:gmx-us

Re: [gmx-users] Protein jumping out of water box

2010-12-03 Thread Justin A. Lemkul
גדעון לפידות wrote: Hi all, I have been running nano second long simulations using Gromacs 4.0.7 and connecting them to create a long time period. on the last run the protein "jumped" out of the water box (the output files were viewed using VMD) does anyone know why this could have happened?