A pleasant good morning to all,
I am getting the following error from the mdout file after a failed
minimization run on a neutralized hydrated protein.
1. RESOURCE USE:
------------------------------------------------------------------------
--------
| Flags: MPI
getting new box info from bottom of inpcrd
Unit 9 Error on OPEN: inpcrd
Can anyone suggest a possible strategy towards the correction of this
problem?
Thanks much.
Patrick
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Received on Fri Apr 18 2008 - 21:12:34 PDT
