On Fri, Apr 13, 2012 at 6:51 PM, Jason Swails <jason.swails.gmail.com>wrote:
>
>
> On Fri, Apr 13, 2012 at 3:55 PM, Ross Walker <ross.rosswalker.co.uk>wrote:
>
>> Ok, done for PMEMD as well.
>>
>> commit 1c962a58b7c6608b08b31d53f08db663f2a8a016
>> Author: Ross Walker <rcw.sdsc.edu>
>> Date: Fri Apr 13 12:53:36 2012 -0700
>>
>> RCW: Fix AMBER 11 -> AMBER 12 in PMEMD - Needs a patch to be made
>> against the released versions.
>>
>
Yuck yuck. Every test output file says "Amber 11 SANDER" at the top. IMO,
this needs to be changed. I was more careful and went through and I think
I hit all of the instances of "Amber 11" in sander and pmemd, but now all
of the tests have to be appropriately updated. This won't get done until
tomorrow -- I will run the tests overnight and run Scott's updater script
tomorrow to fix this up. I want to be careful here, since this is a
tedious (if trivial) update.
All the best,
Jason
--
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Candidate
352-392-4032
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Received on Fri Apr 13 2012 - 16:30:03 PDT