Amber Archive Jul 2005 by messages with attachments

396 messages: Starting Fri Jul 01 2005 - 01:53:01 PDT, Ending Mon Aug 01 2005 - 06:53:00 PDT
This period: Most recent messages
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AMBER: please help us on partial charge calculation of PT complex using RESP peng79.email.unc.edu (Fri Jul 01 2005 - 08:10:31 PDT)
1. Structure_Model.doc (143360 bytes)
2. Gaussian_03_input.doc (24576 bytes)
3. RESP1.IN (662 bytes)
4. RESP2.IN (688 bytes)
AMBER: loading DNA-RNA hybrid in xleap cbala.igib.res.in (Sat Jul 02 2005 - 08:36:59 PDT)
1. hybrid.doc (57344 bytes)
AMBER: Loading a macmodel file complex Yogesh Sabnis (Mon Jul 04 2005 - 08:02:49 PDT)
1. aha144.qxp_u (266829 bytes)
AMBER: question about sander minimization error drugdesign (Thu Jul 07 2005 - 01:37:51 PDT)
1. mfzd.in (145 bytes)
2. mfzd.pdb (82620 bytes)
Re: AMBER: Leap compilation issues Andreas Svrcek-Seiler (Mon Jul 11 2005 - 03:43:39 PDT)
1. Makefile (878 bytes)
Re: AMBER: Leap compilation issues justin litchfield (Mon Jul 11 2005 - 18:25:10 PDT)
1. compiler_info.txt (1155 bytes)
2. antechamber_sander_errors.txt (1729 bytes)
3. serial_p4_ifort.txt (3816 bytes)
AMBER: TI - frcmod file Oliver Hucke (Tue Jul 12 2005 - 12:21:44 PDT)
1. AtoG.jpg (26571 bytes)
Re: AMBER: MM_PBSA help, please opitz.che.udel.edu (Tue Jul 12 2005 - 15:18:50 PDT)
1. mm_pbsa_test.in (3143 bytes)
2. mm_pbsa_test.log (902 bytes)
3. test_traj_com.all.out (276 bytes)
Re: AMBER: molsurf error in MM/PBSA calculation David A. Case (Tue Jul 12 2005 - 18:23:50 PDT)
1. test8.pqr (1609 bytes)
Re: AMBER: AMBER-process_mdout.perl julien (Mon Jul 18 2005 - 00:48:01 PDT)
1. process_mdout.perl (6097 bytes)
AMBER: Re: (瑞星提示-此邮件可能是垃圾邮件)Re: AMBER: Can GB and MS work correctly together in mmpbsa? zhli_2000.126.com (Mon Jul 18 2005 - 18:23:39 PDT)
1. mm_pbsa_calceneent.pm (16500 bytes)
AMBER: FW: Andrew Box (Tue Jul 19 2005 - 19:07:44 PDT)
1. DIST6 (15260 bytes)
2. c.pdb (26312 bytes)
3. map.COMPLEX3 (6055 bytes)
AMBER: P4 EM64T Intel Fortran Compile Problem Zhang Bing (Wed Jul 20 2005 - 19:24:20 PDT)
1. Compiling_Amber8_on_AMD_Opteron_Machines.pdf (58846 bytes)
Re: AMBER: An atom name with 4 characters is not compatible with Leap ? David A. Case (Fri Jul 22 2005 - 10:24:58 PDT)
1. tp.prepin (1435 bytes)
RE: AMBER: An atom name with 4 characters is not compatible with Leap ? Arnoult, Eric [PRDFR] (Wed Jul 27 2005 - 00:20:27 PDT)
1. test.mpdb (2188 bytes)
2. test_prp_resp.in (2576 bytes)