[gmx-users] pullx.xvg / pullf.xvg

[chris.neale at utoronto.ca]

please copy and paste your commands your output. It is unlikely that  
any of us are going to do that tutorial in order to understand your  
question.

-- original message --

Hi,

I am following the umbrella sampling tutorial written by Justin Lemkul.

I was successfully able to run the umbrella sampling simulations, but  
for each configuration it outputted a single xvg file.

For the data analysis i should have pullf.xvg / pullx.xvg files....but  
these files are not outputted after the simulation run.

I haven't made any changes to the .mdp files mentioned in the tutorial.


Please can i know what might have gone wrong that it has not produced  
pullf.xvg and pullx.xvg files.



Kind regards,
chetan.