On Tue, Mar 3, 2009 at 12:52 AM, Catein Catherine wrote:
> Can I restart the job so that the results of the missing 300 steps could be
> continuously written to x_md1.mdcrd and x_md1.result files?
I'm not quite sure it works, but have you tried the -A (instead of -O)
option to sander?
Gustavo.
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Received on Wed Mar 04 2009 - 01:25:30 PST
