Amber Developers Archive Apr 2011 by messages with attachments

174 messages: Starting Fri Apr 01 2011 - 05:30:03 PDT, Ending Sat Apr 30 2011 - 02:00:02 PDT
This period: Most recent messages
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[AMBER-Developers] problems with QM/MM energy conservation David A Case (Tue Apr 05 2011 - 07:21:35 PDT)
1. model.prmtop (384971 bytes)
2. model.inpcrd (180194 bytes)
Re: [AMBER-Developers] Dealing with compiler warnings, etc. Ben Roberts (Wed Apr 06 2011 - 20:02:47 PDT)
1. smime.p7s (3919 bytes)
Re: [AMBER-Developers] AT1.5 5apr11 Thomas Cheatham III (Thu Apr 07 2011 - 16:10:58 PDT)
1. date_ (3444 bytes)
[AMBER-Developers] Problems with sleap and iwrap Ross Walker (Fri Apr 08 2011 - 09:58:59 PDT)
1. originalt.pdb (18023 bytes)
2. leaprc_pdb_tleap.txt (517 bytes)
3. leaprc_pdb_sleap.txt (462 bytes)
4. run_EQMD.sh (3105 bytes)
Re: [AMBER-Developers] sleap bug repro Wei Zhang (Mon Apr 11 2011 - 21:11:03 PDT)
1. xyz.cpp (2782 bytes)
2. energee.cpp (16316 bytes)
3. iwrap.tar.gz (35226 bytes)
Re: [AMBER-Developers] final (!?!) release candidate for AmberTools1.5 Ben Roberts (Tue Apr 12 2011 - 10:10:59 PDT)
1. smime.p7s (2670 bytes)
[AMBER-Developers] AT 1.5 RC Sleap, Rism, and pbsa test failures under Cygwin Daniel Roe (Wed Apr 13 2011 - 09:13:13 PDT)
1. Cygwin-Test-Failures.txt (3848 bytes)
2. 04-12_13-42-17.tgz (1070835 bytes)
Re: [AMBER-Developers] AT 1.5 RC Sleap, Rism, and pbsa test failures under Cygwin Tyler Luchko (Wed Apr 13 2011 - 15:03:27 PDT)
1. patch.txt (3345 bytes)
Re: [AMBER-Developers] Release of AmberTools version 1.5 Ben Roberts (Thu Apr 14 2011 - 09:29:19 PDT)
1. smime.p7s (2670 bytes)