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AMBER Archive (2003)Subject: problem with "Example 3" tutorials
From: S.Swaminathan (swamy_at_www.cdfd.org.in)
hi
I am working on AMBER tutorials. I am facing a problem in Example 3 when I
sander -O -i gcg.in -p prmtop.gcg -c gcg_start.x -o gcg.out
(here gcg.in contains "Minimize water and ions" script.
I am getting the following error from the above program:
==========================================================================
==========================================================================
how do i rectify this ? what is the reason for this ?
thanks
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