Amber Archive Sep 2015 by messages with attachments

Re: [AMBER] hpc error Damiano Spadoni (Thu Sep 03 2015 - 03:16:19 PDT)
1. LAMPLP_heat1.out (12533 bytes)
[AMBER] mmpbsa with Iodine problems 21428087.zju.edu.cn (Fri Sep 04 2015 - 21:48:29 PDT)
1. ligand.prmtop (23872 bytes)
[AMBER] MMPBSA is not performing Asma Abro 28-FBAS/MSBI/F09 (Sun Sep 06 2015 - 22:03:23 PDT)
1. mmpbsa.in (124 bytes)
2. _MMPBSA_gb.mdin (71 bytes)
3. _MMPBSA_pb.mdin (306 bytes)
[AMBER] MCPB problem Kshatresh Dutta Dubey (Thu Sep 10 2015 - 13:25:00 PDT)
1. 1AMP_OH_sidechain.bcl (3289 bytes)
2. 1AMP_OH_sidechain.bcl.log (10269 bytes)
3. 1AMP_OH_fixed_H.pdb (471379 bytes)
4. 1AMP_OH_fixed.pdb (242561 bytes)
[AMBER] Parameterization empirical method Marcelo Andrade Chagas (Fri Sep 11 2015 - 11:40:41 PDT)
1. image.png (37910 bytes)
[AMBER] query ankita mehta (Tue Sep 15 2015 - 06:22:01 PDT)
1. 3i8x_gdp.pdb (519025 bytes)
2. leap_log.log (3407 bytes)
[AMBER] MG ions being misplaced Kalenkiewicz, Andrew (NIH/NICHD) [F] (Fri Sep 18 2015 - 09:44:27 PDT)
1. mysetup.leap (891 bytes)
[AMBER] Minimization Marcelo Andrade Chagas (Fri Sep 18 2015 - 14:13:25 PDT)
1. image.png (57103 bytes)
[AMBER] glycam parameter file Batuhan Kav (Mon Sep 21 2015 - 03:23:39 PDT)
1. 1_amber_2.prmtop (41892 bytes)
2. 1.pdb (11536 bytes)
3. 1.parm7 (36196 bytes)
4. leap (1169 bytes)
Re: [AMBER] glycam parameter file Batuhan Kav (Mon Sep 21 2015 - 07:27:50 PDT)
1. leaprc (2303 bytes)
2. 1_amber_2.inpcrd (2651 bytes)
3. 1.rst7 (2687 bytes)
Re: [AMBER] Freeze atoms to DM Marcelo Andrade Chagas (Mon Sep 21 2015 - 12:55:55 PDT)
1. image.png (102682 bytes)
[AMBER] CpHMD simulation for non protein residues Rahul Ramesh (Wed Sep 23 2015 - 09:05:46 PDT)
1. image.png (9312 bytes)
[AMBER] Fwd: ISC-2015-3BS-09 Sushi Shilpa (Sat Sep 26 2015 - 03:39:40 PDT)
1. ISC-2015-3BS-09-Oral_1_.pdf (59230 bytes)
2. ISC-2015-3BS-09-Oral_2_.pdf (59462 bytes)
3. ISC-2015-3BS-09-Oral_3_.pdf (59340 bytes)
4. ISC-2015-3BS-09-Oral_4_.pdf (59433 bytes)
5. ISC-2015-3BS-09-Oral_5_.pdf (59251 bytes)
6. ISC-2015-3BS-09-Oral_6_.pdf (59291 bytes)
7. ISC-2015-3BS-09-Oral_7_.pdf (59581 bytes)

Last message date: Wed Sep 30 2015 - 15:30:03 PDT
Archived on: Fri Dec 20 2024 - 05:55:16 PST

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