[gmx-users] strange jumping in the frames

2010-09-10 Thread Fahimeh Baftizadeh Baghal
I am running Metadynamics with gromacs, I saw a jump in the frame after the simulation was running for a while, I copy here part of the log file: Step Time Lambda 2055750041115.00.0 Energies (kJ/mol) AngleProper Dih.

Re: [gmx-users] strange jumping in the frames

2010-09-10 Thread Mark Abraham
as you can see the time jumped from 41120.0 to 41125.00391 , while it has to be 41125.0 and then it continue the rest of simulation like this, Do you what is the problem ?!! Probably no problem at all. Numbers that are readily represented in decimal notation, like a