AMBER Archive (2008)

Subject: Re: AMBER: xleap fails to savemol2

From: FyD (fyd_at_q4md-forcefieldtools.org)
Date: Fri Aug 29 2008 - 16:14:42 CDT

Quoting taufik.alsarraj_at_utoronto.ca:

> Thank you for the suggestions. Unfortunately xleap and tlean still
> crashes.

We will have Amber10 installed pretty soon: We will test this...

Using the more basic Tripos mol2 file available @
http://q4md-forcefieldtools.org/REDDB/up/W-1/tripos1.mol2
may I ask you to run this simple script:

TEST = loadmol2 tripos1.mol2
savemol2 TEST tripos2.mol2 0

Does it crash also ?

regards, Francois

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