[gmx-users] Re: disk space check

[Dmitry Kovaskyy]

Hi,

to David
> Good idea, if you write a function I'll add it to grompp.
> It should read the inputrec after processing and know the number of
> atoms...
Where I can get a description of xtc and trr file formats?
( Unfortunately, I'm not familiar with C and should provide all
nesessary info to person who will do it)

Dima
--
PhD Student Dmytro Kovalskyy
MD Group 
Rijksuniversiteit Groningen
Nijenborgh 4
9747 AG Groningen
The Netherlands

e-mail: d.kovalskyy at chem.rug.nl