Hi, ambers,
I meet a problem when i use amber 9 to do the minimisation. the
mdout file give me the error message is as below:
--------------------------------------------------------------------------------
1. RESOURCE USE:
--------------------------------------------------------------------------------
| Flags: MPI
getting new box info from bottom of inpcrd
| INFO: Old style inpcrd file read
peek_ewald_inpcrd: SHOULD NOT BE HERE
then the simulation was killed. I check the inpcrd file the box
information on the bottom indeed. could anybody tell me why?
Thanks a lot!!
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Received on Wed May 28 2008 - 06:07:57 PDT
