Re: [AMBER] unable to solvate a polymer

From: David Case <david.case.rutgers.edu>
Date: Wed, 22 Mar 2017 11:18:00 -0400

On Wed, Mar 22, 2017, Jon Mujika wrote:

> source leaprc.gaff
> source leaprc.water.tip3p
>
> > source leaprc.water.tip3p
> Could not open file leaprc.water.tip3p: not found

Was there any similar error about not being able to find leaprc.gaff? As
Bill pointed out, those two files are in the same directory. Check that
your AMBERHOME directory is set correctly. You may have to experiment some to
figure out what is going on.

....dac


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Received on Wed Mar 22 2017 - 08:30:03 PDT
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