On 02/12/2013 03:33 PM, Justin Lemkul wrote:
gmxcheck is your friend, as well as the wiki.
http://www.gromacs.org/Documentation/File_Formats/Checkpoint_File
A checkpoint file is always written at the last step of the
simulation, which seems to be what you were asking for previously.
-Justin
IC. that's really helpful.
thanks a lot
Albert
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