Amber Archive Oct 2013: by subject

[AMBER] [Amber]Question about softcore
- yuandandan (Fri Oct 11 2013 - 06:48:50 PDT)
[AMBER] A problem with a specific input in pmemd.cuda.MPI. 4 GPU fails, 2 GPU works fine.
- Ross Walker (Fri Oct 04 2013 - 11:41:17 PDT)
- Jeremy Hallum (Fri Oct 04 2013 - 11:26:52 PDT)
[AMBER] About calculating entropy
- Tivani Mashamba (Thu Oct 31 2013 - 08:39:54 PDT)
- Hannes Loeffler (Thu Oct 31 2013 - 07:03:28 PDT)
- Tivani Mashamba (Thu Oct 31 2013 - 06:47:21 PDT)
- Jason Swails (Thu Oct 31 2013 - 06:14:59 PDT)
- Olayide Arodola (Thu Oct 31 2013 - 04:26:52 PDT)
[AMBER] about error with "Must have more residues than processors!"
- Biao Ma (Wed Oct 02 2013 - 20:47:49 PDT)
- Jason Swails (Tue Oct 01 2013 - 09:26:01 PDT)
- Biao Ma (Tue Oct 01 2013 - 09:00:20 PDT)
[AMBER] About foundations of T-REMD
- Brian Radak (Fri Oct 25 2013 - 07:42:28 PDT)
- Adrian Roitberg (Fri Oct 25 2013 - 07:39:28 PDT)
- Francesco Pietra (Fri Oct 25 2013 - 07:28:51 PDT)
[AMBER] About INP in case of MS=1
- Ray Luo, Ph.D. (Wed Oct 09 2013 - 09:53:43 PDT)
- Hiromasa WATANABE (Tue Oct 08 2013 - 23:03:58 PDT)
- Ray Luo, Ph.D. (Thu Oct 03 2013 - 10:00:53 PDT)
- Hiromasa WATANABE (Wed Oct 02 2013 - 22:55:00 PDT)
[AMBER] about rms atomic fluctuation for protein crystal .thank you very much!
- Pawel (Wed Oct 30 2013 - 06:12:50 PDT)
- Yongxiu Li (Tue Oct 29 2013 - 01:03:39 PDT)
- Pawel (Tue Oct 15 2013 - 16:26:42 PDT)
- Yongxiu Li (Tue Oct 15 2013 - 06:09:33 PDT)
- Pawel (Mon Oct 14 2013 - 09:04:40 PDT)
- Yongxiu Li (Mon Oct 14 2013 - 04:36:06 PDT)
[AMBER] About the Mg charge in AMBER FF
- Andreas Goetz (Fri Oct 04 2013 - 19:20:35 PDT)
- Jason Swails (Fri Oct 04 2013 - 05:38:02 PDT)
- George Patargias (Fri Oct 04 2013 - 05:36:32 PDT)
- FyD (Fri Oct 04 2013 - 05:07:43 PDT)
- Jacopo Sgrignani (Fri Oct 04 2013 - 03:01:43 PDT)
- George Patargias (Fri Oct 04 2013 - 02:28:36 PDT)
[AMBER] acclerated molecular dynamics alphaP
- Daniel Roe (Tue Oct 29 2013 - 08:19:58 PDT)
- Nicole Ippolito (Tue Oct 29 2013 - 07:59:22 PDT)
[AMBER] Amber 12 Updater error on Arch linux
- Jason Swails (Wed Oct 30 2013 - 04:20:18 PDT)
- M. Reza Ganjalikhany (Wed Oct 30 2013 - 02:52:16 PDT)
[AMBER] AMBER Digest, Vol 659, Issue 1
- Sohag Biswas (Wed Oct 30 2013 - 23:23:10 PDT)
[AMBER] AMBER ff99Sbildn
- Shomesankar Bhunia (Wed Oct 09 2013 - 08:59:56 PDT)
- Jason Swails (Wed Oct 09 2013 - 08:45:01 PDT)
- Shomesankar Bhunia (Wed Oct 09 2013 - 08:34:38 PDT)
- Jason Swails (Wed Oct 09 2013 - 08:20:26 PDT)
- Shomesankar Bhunia (Wed Oct 09 2013 - 07:20:48 PDT)
[AMBER] Amber99SB force field
- Shomesankar Bhunia (Tue Oct 08 2013 - 18:46:55 PDT)
- Shomesankar Bhunia (Tue Oct 08 2013 - 12:01:35 PDT)
- Carlos Simmerling (Tue Oct 08 2013 - 11:18:07 PDT)
- Shomesankar Bhunia (Tue Oct 08 2013 - 11:13:52 PDT)
[AMBER] ambertools patch 19 fails
- Jason Swails (Mon Oct 07 2013 - 08:58:53 PDT)
- Matthew Wampole (Mon Oct 07 2013 - 07:57:46 PDT)
[AMBER] AmberTools13
- Concha, Monica (Fri Oct 25 2013 - 14:37:43 PDT)
- Daniel Roe (Fri Oct 25 2013 - 14:05:11 PDT)
- Jason Swails (Fri Oct 25 2013 - 14:05:06 PDT)
- Concha, Monica (Fri Oct 25 2013 - 13:42:29 PDT)
[AMBER] AmberTools13 and Amber11
- Alan (Fri Oct 11 2013 - 09:16:23 PDT)
- Jason Swails (Fri Oct 11 2013 - 08:45:26 PDT)
- Alan (Fri Oct 11 2013 - 08:07:10 PDT)
[AMBER] AMBERTOOLS13 test error: 01_Generalized_Born and 03_Alanine_Scanning
- Jason Swails (Thu Oct 24 2013 - 05:21:53 PDT)
- marco.molinari (Thu Oct 24 2013 - 03:55:11 PDT)
[AMBER] AMBERTOOLS13 test error: 01_Generalized_Born and, 03_Alanine_Scanning (Jason Swails)
- marco.molinari (Fri Oct 25 2013 - 05:42:27 PDT)
[AMBER] Ambiguity in PMF calculated from umbrella sampling of a dihedral angle
- Jason Swails (Tue Oct 01 2013 - 09:20:29 PDT)
- Mohan Pradhan (Tue Oct 01 2013 - 06:11:22 PDT)
- Jason Swails (Tue Oct 01 2013 - 04:50:01 PDT)
- Mohan Pradhan (Tue Oct 01 2013 - 04:11:32 PDT)
[AMBER] Block Averaging of Trajectory
- Mathias Gruber (Tue Oct 08 2013 - 06:03:23 PDT)
[AMBER] calculatie the energy between two groups of atoms from an MD trajectory, is it possible?
- Daniel Roe (Thu Oct 31 2013 - 08:59:24 PDT)
- Jose Borreguero (Thu Oct 31 2013 - 08:45:43 PDT)
- Jose Borreguero (Wed Oct 30 2013 - 05:56:27 PDT)
- Brian Radak (Tue Oct 29 2013 - 14:24:52 PDT)
- Jose Borreguero (Tue Oct 29 2013 - 13:37:07 PDT)
[AMBER] changeLJ14Pair
- Jason Swails (Fri Oct 04 2013 - 07:04:45 PDT)
- CHAMI F. (Fri Oct 04 2013 - 04:52:24 PDT)
[AMBER] Constant pH with enzyme and substrate
- Nicole Ippolito (Fri Oct 25 2013 - 14:51:58 PDT)
- Daniel Roe (Fri Oct 25 2013 - 13:06:23 PDT)
- Nicole Ippolito (Fri Oct 25 2013 - 11:00:28 PDT)
[AMBER] Constant pH with ligand
- Nicole Ippolito (Wed Oct 16 2013 - 04:37:49 PDT)
- FyD (Tue Oct 15 2013 - 22:25:53 PDT)
- Jason Swails (Tue Oct 15 2013 - 17:33:04 PDT)
- Nicole Ippolito (Tue Oct 15 2013 - 14:55:52 PDT)
[AMBER] CYM residue problem(MCPB)
- FyD (Fri Oct 18 2013 - 12:16:31 PDT)
- Jason Swails (Fri Oct 18 2013 - 07:11:00 PDT)
- houcemeddine (Fri Oct 18 2013 - 06:11:14 PDT)
- FyD (Thu Oct 17 2013 - 11:53:19 PDT)
- Jason Swails (Thu Oct 17 2013 - 08:49:08 PDT)
- houcemeddine (Thu Oct 17 2013 - 08:29:17 PDT)
[AMBER] Difference between the .crd file format in AMBER-7 and AMBER-12
- anu chandra (Sun Oct 27 2013 - 21:50:49 PDT)
- case (Sat Oct 26 2013 - 05:58:46 PDT)
- anu chandra (Sat Oct 26 2013 - 00:40:19 PDT)
[AMBER] Distributions of the phi and psi torsion angles during MD simulations
- Baptiste Legrand (Thu Oct 10 2013 - 14:50:31 PDT)
- Jason Swails (Thu Oct 10 2013 - 06:45:17 PDT)
- Baptiste Legrand (Thu Oct 10 2013 - 00:51:54 PDT)
[AMBER] DNA with NAB
- case (Sat Oct 26 2013 - 06:07:45 PDT)
- Jio M (Fri Oct 25 2013 - 07:14:34 PDT)
- case (Thu Oct 24 2013 - 16:50:25 PDT)
- Jio M (Thu Oct 24 2013 - 12:23:39 PDT)
- Jio M (Tue Oct 22 2013 - 08:42:21 PDT)
- David A Case (Mon Oct 14 2013 - 04:46:57 PDT)
- Jio M (Sun Oct 13 2013 - 15:47:52 PDT)
[AMBER] Doubt regarding the metadynamics simulation
- Jason Swails (Thu Oct 17 2013 - 09:21:20 PDT)
- Robert Molt (Thu Oct 17 2013 - 09:14:17 PDT)
- Adrian Roitberg (Thu Oct 17 2013 - 09:10:55 PDT)
- Ravi Tripathi (Thu Oct 17 2013 - 09:08:18 PDT)
- Adrian Roitberg (Thu Oct 17 2013 - 08:01:42 PDT)
- Ravi Tripathi (Thu Oct 17 2013 - 07:59:31 PDT)
[AMBER] Erro in the Thermodynamic Intergration using soft core potentials"
- David A Case (Thu Oct 03 2013 - 09:08:47 PDT)
- 冉挺 (Thu Oct 03 2013 - 06:07:40 PDT)
- David A Case (Wed Oct 02 2013 - 04:39:31 PDT)
- 冉挺 (Wed Oct 02 2013 - 03:52:36 PDT)
- 冉挺 (Tue Oct 01 2013 - 05:35:32 PDT)
- David A Case (Tue Oct 01 2013 - 04:37:25 PDT)
- 冉挺 (Tue Oct 01 2013 - 02:17:00 PDT)
[AMBER] Error - PMEMD.MPI cannot understand line in rst file
- Daniel Roe (Mon Oct 28 2013 - 06:57:39 PDT)
- rohitarora10.gmail.com (Mon Oct 28 2013 - 04:34:22 PDT)
[AMBER] Error in antechamber Installation
- Jason Swails (Sun Oct 06 2013 - 05:04:47 PDT)
- Vijayalaxmi Sahoo (Sat Oct 05 2013 - 22:27:27 PDT)
[AMBER] ERROR in DISTANCE RESTRAINT
- David A Case (Tue Oct 08 2013 - 12:29:50 PDT)
- Ross Walker (Tue Oct 08 2013 - 10:45:13 PDT)
- Brian Radak (Tue Oct 08 2013 - 10:30:38 PDT)
- Sourav Purohit (Tue Oct 08 2013 - 10:21:26 PDT)
[AMBER] Error message from pmemd.cuda
- Niel Henriksen (Wed Oct 16 2013 - 13:46:33 PDT)
- Niel Henriksen (Wed Oct 16 2013 - 13:44:43 PDT)
- Brian Radak (Wed Oct 16 2013 - 13:30:00 PDT)
[AMBER] example of MTKpp on Ambertools 13
- setyanto md (Mon Oct 21 2013 - 23:31:25 PDT)
- Jason Swails (Mon Oct 21 2013 - 08:03:23 PDT)
- Daniel Roe (Mon Oct 21 2013 - 07:58:43 PDT)
- setyanto md (Mon Oct 21 2013 - 07:18:30 PDT)
[AMBER] Exceed character limit in bellyrestraint mask selection
- Jason Swails (Tue Oct 22 2013 - 04:52:24 PDT)
- Mike Limb (Tue Oct 22 2013 - 03:39:32 PDT)
- Jason Swails (Fri Oct 18 2013 - 11:05:47 PDT)
- Mike Limb (Fri Oct 18 2013 - 10:35:44 PDT)
- Jason Swails (Tue Oct 15 2013 - 09:34:01 PDT)
- Mike Limb (Tue Oct 15 2013 - 08:29:18 PDT)
[AMBER] Free binding energy calculations for Zinc dependent ligands
- Jason Swails (Wed Oct 30 2013 - 05:52:10 PDT)
- Tivani Mashamba (Wed Oct 30 2013 - 02:09:05 PDT)
[AMBER] Fwd: DMPC GAFF lipid membrane is freezing at 303 K.
- Dickson, Callum (Wed Oct 09 2013 - 05:44:06 PDT)
- Ross Walker (Wed Oct 09 2013 - 05:19:35 PDT)
- Subbarao Kanchi (Wed Oct 09 2013 - 01:44:46 PDT)
- Dickson, Callum (Wed Oct 09 2013 - 01:07:35 PDT)
- Subbarao Kanchi (Sun Oct 06 2013 - 22:05:57 PDT)
- Subbarao Kanchi (Tue Oct 01 2013 - 19:25:11 PDT)
- Ross Walker (Tue Oct 01 2013 - 09:04:27 PDT)
[AMBER] Fwd: requesting in executing CHAMBER
- Soumya Lipsa Rath (Mon Oct 21 2013 - 22:57:30 PDT)
[AMBER] Fwd: Shifting molecules by a box length
- Daniel Roe (Thu Oct 10 2013 - 08:17:44 PDT)
- Heribert Reis (Thu Oct 10 2013 - 07:41:11 PDT)
[AMBER] GAFF angle term constants with phosphor or sulphur
- James Murdock (Mon Oct 14 2013 - 06:13:16 PDT)
- Igor Marques (Tue Oct 08 2013 - 06:30:49 PDT)
[AMBER] Generating reservoirs for non-Boltzmann T-RREMD
- Jason Swails (Tue Oct 08 2013 - 05:01:24 PDT)
- Niel Henriksen (Mon Oct 07 2013 - 11:27:56 PDT)
- Eugene Yedvabny (Sun Oct 06 2013 - 21:58:04 PDT)
- Niel Henriksen (Sun Oct 06 2013 - 21:18:00 PDT)
- Eugene Yedvabny (Fri Oct 04 2013 - 17:34:32 PDT)
- Niel Henriksen (Fri Oct 04 2013 - 13:25:18 PDT)
- Eugene Yedvabny (Fri Oct 04 2013 - 12:50:42 PDT)
[AMBER] Generating topology files for two proteins in a single input pdb
- George Green (Tue Oct 01 2013 - 11:13:49 PDT)
- George Green (Tue Oct 01 2013 - 04:55:11 PDT)
- Jason Swails (Tue Oct 01 2013 - 04:54:21 PDT)
- George Green (Tue Oct 01 2013 - 04:52:54 PDT)
- George Green (Tue Oct 01 2013 - 04:49:59 PDT)
- George Green (Tue Oct 01 2013 - 04:48:42 PDT)
- David A Case (Tue Oct 01 2013 - 04:43:07 PDT)
[AMBER] Generation of melting curves
- Carlos Simmerling (Mon Oct 07 2013 - 07:49:43 PDT)
- Daniel Roe (Mon Oct 07 2013 - 07:39:04 PDT)
- Brian Radak (Mon Oct 07 2013 - 06:39:08 PDT)
- Gargi Borgohai (Sun Oct 06 2013 - 20:59:11 PDT)
[AMBER] Hbond analysis
- Daniel Roe (Wed Oct 30 2013 - 13:36:51 PDT)
- Fabrício Bracht (Wed Oct 30 2013 - 13:31:25 PDT)
- Fabrício Bracht (Wed Oct 30 2013 - 13:28:36 PDT)
- Daniel Roe (Wed Oct 30 2013 - 13:12:25 PDT)
- Fabrício Bracht (Wed Oct 30 2013 - 13:02:10 PDT)
- Daniel Roe (Wed Oct 30 2013 - 12:01:25 PDT)
- Fabrício Bracht (Wed Oct 30 2013 - 11:34:26 PDT)
[AMBER] High energy in per-residue MMPBSA calculation
- anu chandra (Thu Oct 10 2013 - 05:22:50 PDT)
[AMBER] High Temperature at NSTEP = 0
- Carlos Simmerling (Tue Oct 22 2013 - 10:27:11 PDT)
- Brian Radak (Tue Oct 22 2013 - 08:57:03 PDT)
- Alessandra Lacetera (Tue Oct 22 2013 - 08:41:12 PDT)
[AMBER] How do I use MMPBSA.py for namd .dcd file?
- Jason Swails (Mon Oct 14 2013 - 06:16:30 PDT)
- sudipta (Mon Oct 14 2013 - 06:08:01 PDT)
- Jason Swails (Sat Oct 12 2013 - 17:06:05 PDT)
- sudipta (Sat Oct 12 2013 - 10:31:35 PDT)
[AMBER] How to calculate the free energy change of a chemical reaction by the thermodynamic integration approach?
- Brian Radak (Fri Oct 11 2013 - 06:30:45 PDT)
- cwt (Thu Oct 10 2013 - 23:18:00 PDT)
[AMBER] How to deal with duplicate frames during MD?
- Jason Swails (Sat Oct 19 2013 - 06:13:56 PDT)
- rohitarora10.gmail.com (Fri Oct 18 2013 - 16:23:21 PDT)
- rohitarora10.gmail.com (Fri Oct 18 2013 - 07:20:10 PDT)
- Daniel Roe (Fri Oct 18 2013 - 06:59:42 PDT)
- rohitarora10.gmail.com (Fri Oct 18 2013 - 01:34:38 PDT)
[AMBER] How to run npt simulation if IFBOX=0 in .prmtop file?
- Dongshan Wei (Thu Oct 10 2013 - 06:58:37 PDT)
- Jason Swails (Thu Oct 10 2013 - 05:56:41 PDT)
- Dongshan Wei (Thu Oct 10 2013 - 05:43:30 PDT)
[AMBER] How to use TIP4P/2005 water model
- James Maier (Sat Oct 26 2013 - 08:56:02 PDT)
- Deborah Howe (Sat Oct 26 2013 - 08:20:01 PDT)
- case (Sat Oct 26 2013 - 05:54:23 PDT)
- Deborah Howe (Fri Oct 25 2013 - 19:57:22 PDT)
[AMBER] huge values for the vibrational entropy from ptraj
- Vlad Cojocaru (Thu Oct 31 2013 - 06:03:40 PDT)
- David A Case (Thu Oct 31 2013 - 04:44:22 PDT)
- Vlad Cojocaru (Thu Oct 31 2013 - 02:21:15 PDT)
- Vlad Cojocaru (Tue Oct 29 2013 - 08:53:11 PDT)
- Daniel Roe (Tue Oct 29 2013 - 08:12:40 PDT)
- Jason Swails (Tue Oct 29 2013 - 08:05:29 PDT)
- Jason Swails (Tue Oct 29 2013 - 08:00:50 PDT)
- Vlad Cojocaru (Tue Oct 29 2013 - 06:50:53 PDT)
- David A Case (Tue Oct 29 2013 - 06:21:25 PDT)
- Vlad Cojocaru (Tue Oct 29 2013 - 05:37:52 PDT)
- David A Case (Tue Oct 29 2013 - 04:45:24 PDT)
- Vlad Cojocaru (Tue Oct 29 2013 - 01:56:31 PDT)
[AMBER] Hydrogen Bond Term in Amber ff99SB forcefield
- David A Case (Mon Oct 07 2013 - 05:16:28 PDT)
- Asmit Bhowmick (Sun Oct 06 2013 - 18:48:52 PDT)
[AMBER] I/O errors while using CHARMM psf with CHAMBER
- Debayan Chakraborty (Thu Oct 10 2013 - 16:23:01 PDT)
[AMBER] idecomp does not work for canonical-residues
- kurisaki (Mon Oct 28 2013 - 04:00:53 PDT)
- Jason Swails (Mon Oct 28 2013 - 03:22:13 PDT)
- kurisaki (Sun Oct 27 2013 - 18:26:49 PDT)
- Jason Swails (Sun Oct 27 2013 - 09:05:54 PDT)
- kurisaki (Sun Oct 27 2013 - 06:01:56 PDT)
- Jason Swails (Sun Oct 27 2013 - 05:23:58 PDT)
- kurisaki (Sat Oct 26 2013 - 23:43:00 PDT)
[AMBER] igb=7, 8 incompatible with the ILDN modifications of ff99SB
- Jason Swails (Thu Oct 24 2013 - 07:52:44 PDT)
- Vlad Cojocaru (Thu Oct 24 2013 - 07:35:17 PDT)
[AMBER] inquiry
- Vaibhav Dixit (Mon Oct 14 2013 - 02:43:03 PDT)
[AMBER] Installation error
- Jason Swails (Thu Oct 31 2013 - 11:36:14 PDT)
- David A Case (Thu Oct 31 2013 - 06:45:06 PDT)
- Jason Swails (Thu Oct 31 2013 - 06:27:25 PDT)
- Dhananjay (Thu Oct 31 2013 - 04:41:38 PDT)
- Jason Swails (Thu Oct 31 2013 - 04:36:13 PDT)
- Dhananjay (Thu Oct 31 2013 - 04:33:37 PDT)
- Jason Swails (Thu Oct 31 2013 - 04:22:25 PDT)
- Dhananjay (Thu Oct 31 2013 - 04:07:43 PDT)
- David A Case (Wed Oct 30 2013 - 04:52:45 PDT)
- Jason Swails (Wed Oct 30 2013 - 04:43:58 PDT)
- Dhananjay (Wed Oct 30 2013 - 01:41:49 PDT)
[AMBER] ionic strength conversion between MMPBSA.py and PBSA
- Jason Swails (Fri Oct 25 2013 - 08:59:31 PDT)
- Vlad Cojocaru (Fri Oct 25 2013 - 08:44:53 PDT)
- Jason Swails (Fri Oct 25 2013 - 08:08:13 PDT)
- Vlad Cojocaru (Fri Oct 25 2013 - 07:21:12 PDT)
[AMBER] Iron(III)Hydroxide complexing with Enterobactin (quantum chemistry calculations?)
- FyD (Sun Oct 13 2013 - 01:45:33 PDT)
- Jonathan Saboury (Sat Oct 12 2013 - 21:43:07 PDT)
[AMBER] ITN Marie Curie positions available for early-stage researchers
- Paolo Ruggerone (Fri Oct 04 2013 - 02:25:08 PDT)
[AMBER] Leap ff10 and Sodium ion
- case (Thu Oct 24 2013 - 04:25:08 PDT)
- Johannes Zuegg (Wed Oct 23 2013 - 17:05:56 PDT)
[AMBER] Making Au surface using xleap
- Brian Radak (Fri Oct 25 2013 - 11:23:25 PDT)
- Hoshin Kim (Fri Oct 25 2013 - 08:39:30 PDT)
[AMBER] mdcrd to dcd
- Daniel Roe (Thu Oct 31 2013 - 06:42:45 PDT)
- kurisaki (Thu Oct 31 2013 - 04:49:45 PDT)
- 石坪江梨花 (Thu Oct 31 2013 - 04:36:18 PDT)
[AMBER] MMGBSA, Generalized Born, protein-nucleic acid complex
- Hai Nguyen (Thu Oct 24 2013 - 11:37:21 PDT)
- Vlad Cojocaru (Thu Oct 24 2013 - 05:53:45 PDT)
[AMBER] MMPBSA calculation
- Mary Varughese (Tue Oct 22 2013 - 15:57:59 PDT)
[AMBER] MMPBSA error
- Ray Luo, Ph.D. (Thu Oct 10 2013 - 14:30:35 PDT)
- Symon Gathiaka (Thu Oct 10 2013 - 12:36:02 PDT)
[AMBER] MMPBSA problem with CHAMBER generated topology file
- Jason Swails (Tue Oct 22 2013 - 04:56:44 PDT)
- Bill Miller III (Mon Oct 21 2013 - 20:22:53 PDT)
- Uday Midya (Mon Oct 21 2013 - 20:15:06 PDT)
[AMBER] MMPBSA, ligand sequence
- maghtar (Fri Oct 25 2013 - 07:17:32 PDT)
- Jason Swails (Fri Oct 25 2013 - 04:22:32 PDT)
- maghtar (Fri Oct 25 2013 - 03:29:28 PDT)
[AMBER] MMPBSA.py error
- Jason Swails (Thu Oct 24 2013 - 07:40:23 PDT)
- Rasha Alqus (Thu Oct 24 2013 - 07:31:44 PDT)
- Jason Swails (Thu Oct 24 2013 - 07:08:57 PDT)
- Rasha Alqus (Thu Oct 24 2013 - 06:02:32 PDT)
- Jason Swails (Wed Oct 23 2013 - 04:40:09 PDT)
- Rasha Alqus (Wed Oct 23 2013 - 03:18:54 PDT)
- Rasha Alqus (Wed Oct 23 2013 - 03:11:53 PDT)
[AMBER] MMPBSA.py MPI problem on TACC Stampede
- Sorensen, Jesper (Tue Oct 01 2013 - 10:19:11 PDT)
- Jason Swails (Tue Oct 01 2013 - 04:36:10 PDT)
- Sorensen, Jesper (Mon Sep 30 2013 - 17:55:49 PDT)
[AMBER] MMPBSA.py problem
- Jason Swails (Thu Oct 24 2013 - 07:22:03 PDT)
- Indrajit Deb (Thu Oct 24 2013 - 05:31:01 PDT)
[AMBER] mmpbsa_py_energy and PBSA options
- Ray Luo, Ph.D. (Fri Oct 25 2013 - 11:54:27 PDT)
- Vlad Cojocaru (Fri Oct 25 2013 - 11:18:02 PDT)
- Ray Luo, Ph.D. (Fri Oct 25 2013 - 10:52:56 PDT)
- Vlad Cojocaru (Fri Oct 25 2013 - 10:08:52 PDT)
- Ray Luo, Ph.D. (Fri Oct 25 2013 - 09:56:01 PDT)
- Vlad Cojocaru (Fri Oct 25 2013 - 09:02:39 PDT)
[AMBER] MMPSA: PB Bomb in pb_aaradi(): ...
- Ray Luo, Ph.D. (Fri Oct 11 2013 - 10:59:11 PDT)
- psu4.uic.edu (Fri Oct 11 2013 - 10:39:56 PDT)
[AMBER] Modified Cysteine
- FyD (Tue Oct 01 2013 - 08:17:42 PDT)
- Devlina Chakravarty (Tue Oct 01 2013 - 04:36:09 PDT)
[AMBER] Monte Carlo Method/Simulation in AMBER 12
- David A Case (Thu Oct 31 2013 - 04:44:53 PDT)
- Jason Swails (Thu Oct 31 2013 - 04:24:59 PDT)
- Emmanuel Oluwatobi SALAWU (Thu Oct 31 2013 - 03:38:15 PDT)
[AMBER] MPI install with openmpi
- David A Case (Mon Oct 07 2013 - 05:14:12 PDT)
- Jason Swails (Sun Oct 06 2013 - 07:17:30 PDT)
- Makoto Chikira (Sun Oct 06 2013 - 06:36:27 PDT)
- Makoto Chikira (Sat Oct 05 2013 - 18:23:43 PDT)
- case (Sat Oct 05 2013 - 09:50:18 PDT)
- Makoto Chikira (Sat Oct 05 2013 - 08:37:08 PDT)
- case (Sat Oct 05 2013 - 06:28:20 PDT)
- Makoto Chikira (Sat Oct 05 2013 - 00:33:21 PDT)
[AMBER] NAB : Orienting a molecule
- case (Sat Oct 05 2013 - 06:19:57 PDT)
- Daniel Roe (Fri Oct 04 2013 - 13:38:00 PDT)
- Aldo Segura (Fri Oct 04 2013 - 12:53:09 PDT)
- HIMANSHU JOSHI (Fri Oct 04 2013 - 11:33:48 PDT)
[AMBER] namelist input > 80 columns
- case (Wed Oct 23 2013 - 11:18:34 PDT)
- thomas.fox.boehringer-ingelheim.com (Tue Oct 22 2013 - 04:43:07 PDT)
- thomas.fox.boehringer-ingelheim.com (Tue Oct 22 2013 - 02:41:32 PDT)
[AMBER] optimization using gaussian and RESP using antechamber
- Tanmoy Paul (Wed Oct 30 2013 - 06:15:32 PDT)
- Bajarang Kumbhar (Mon Oct 21 2013 - 04:29:16 PDT)
[AMBER] output of diffusion data doesn't show two columns for big number values
- Daniel Roe (Sat Oct 19 2013 - 09:32:09 PDT)
- Vijay Manickam Achari (Sat Oct 19 2013 - 04:01:58 PDT)
[AMBER] Parameter Discrepancy in Walker Tutorial B1?
- Jason Swails (Tue Oct 08 2013 - 04:50:06 PDT)
- Robert Molt (Mon Oct 07 2013 - 18:58:12 PDT)
[AMBER] parmchk doesn't recognize the changes made in leaprc.ff99SB and parm.99
- Sajeewa Pemasinghe (Sat Oct 19 2013 - 12:50:50 PDT)
- Jason Swails (Fri Oct 18 2013 - 06:55:07 PDT)
- Sajeewa Pemasinghe (Fri Oct 18 2013 - 06:06:36 PDT)
[AMBER] parmed.py bug when using the "parmout" command ?
- Vlad Cojocaru (Thu Oct 24 2013 - 12:46:11 PDT)
- Jason Swails (Thu Oct 24 2013 - 10:43:54 PDT)
- Vlad Cojocaru (Thu Oct 24 2013 - 10:36:33 PDT)
- Jason Swails (Thu Oct 24 2013 - 10:35:42 PDT)
- Jan-Philip Gehrcke (Thu Oct 24 2013 - 10:30:22 PDT)
- Vlad Cojocaru (Thu Oct 24 2013 - 10:20:35 PDT)
- Vlad Cojocaru (Thu Oct 24 2013 - 10:15:31 PDT)
- Jason Swails (Thu Oct 24 2013 - 10:09:27 PDT)
- Vlad Cojocaru (Thu Oct 24 2013 - 09:31:41 PDT)
- Vlad Cojocaru (Thu Oct 24 2013 - 09:16:04 PDT)
- Jason Swails (Thu Oct 24 2013 - 08:42:54 PDT)
- Vlad Cojocaru (Thu Oct 24 2013 - 08:14:02 PDT)
- Brian Radak (Thu Oct 24 2013 - 08:06:28 PDT)
- Vlad Cojocaru (Thu Oct 24 2013 - 07:55:12 PDT)
[AMBER] PCA analysis and amber prmtop file
- Jason Swails (Tue Oct 22 2013 - 04:58:07 PDT)
- Neha Gandhi (Tue Oct 22 2013 - 01:29:37 PDT)
[AMBER] Phenyl-boronic acid derivatives lacking of parameter in Mol2 file
- 陈发生 (Sun Oct 06 2013 - 20:48:07 PDT)
[AMBER] PMEMD trajectory and MMPBSA
- Sangita Kachhap (Mon Oct 14 2013 - 08:20:07 PDT)
- Bill Miller III (Mon Oct 14 2013 - 05:33:07 PDT)
- Sangita Kachhap (Sun Oct 13 2013 - 22:46:51 PDT)
[AMBER] PMF for 2 Arginines
- Carlos Simmerling (Wed Oct 16 2013 - 10:50:25 PDT)
- Brian Radak (Wed Oct 16 2013 - 10:23:21 PDT)
- Nihal Korkmaz (Wed Oct 16 2013 - 09:38:32 PDT)
- Brian Radak (Wed Oct 16 2013 - 07:30:21 PDT)
- Nihal Korkmaz (Tue Oct 15 2013 - 20:44:52 PDT)
[AMBER] Predicting druggable hotspots
- anu chandra (Wed Oct 02 2013 - 03:36:15 PDT)
[AMBER] Problem about water Cap with igb=10
- case (Thu Oct 24 2013 - 16:52:16 PDT)
- Tong ZHU (Sun Oct 13 2013 - 07:11:39 PDT)
[AMBER] problem after minimization of pure DMF
- FyD (Wed Oct 30 2013 - 04:59:20 PDT)
- David A Case (Mon Oct 28 2013 - 04:44:36 PDT)
- Sohag Biswas (Sun Oct 27 2013 - 21:09:31 PDT)
[AMBER] problem for prmtop and inpcrd file generation
- Bajarang Kumbhar (Thu Oct 17 2013 - 22:44:42 PDT)
[AMBER] Problem in antechamber execution Problem in antechamber execution problem in antechamber execution
- Daniel Roe (Tue Oct 01 2013 - 09:08:48 PDT)
- Tanmoy Paul (Tue Oct 01 2013 - 08:15:21 PDT)
[AMBER] Problem in creating .mol2 and .frcmod files
- David A Case (Wed Oct 09 2013 - 07:22:02 PDT)
- Vijayalaxmi Sahoo (Wed Oct 09 2013 - 06:38:28 PDT)
- Vijayalaxmi Sahoo (Mon Oct 07 2013 - 08:33:16 PDT)
- Jason Swails (Mon Oct 07 2013 - 07:40:27 PDT)
- Vijayalaxmi Sahoo (Mon Oct 07 2013 - 06:48:50 PDT)
[AMBER] Problem in deriving RESP charges with RED-3.52 tools
- Sajeewa Pemasinghe (Sun Oct 20 2013 - 08:35:31 PDT)
- FyD (Tue Oct 15 2013 - 22:21:40 PDT)
- Sajeewa Pemasinghe (Tue Oct 15 2013 - 16:47:16 PDT)
- Sajeewa Pemasinghe (Tue Oct 15 2013 - 14:19:12 PDT)
- FyD (Sun Oct 13 2013 - 07:02:23 PDT)
- Sajeewa Pemasinghe (Sun Oct 13 2013 - 05:41:00 PDT)
- FyD (Sun Oct 13 2013 - 00:45:40 PDT)
- Sajeewa Pemasinghe (Sat Oct 12 2013 - 23:12:39 PDT)
[AMBER] PROBLEM IN QM/MM RUN
- Gustavo Seabra (Sat Oct 19 2013 - 08:49:11 PDT)
- Tanmoy Paul (Sat Oct 19 2013 - 00:17:48 PDT)
[AMBER] problem in saving prmtop file in ff12SB force field
- Subrata Paul (Mon Oct 28 2013 - 07:37:55 PDT)
- Daniel Roe (Mon Oct 28 2013 - 07:04:09 PDT)
- Subrata Paul (Mon Oct 28 2013 - 06:58:09 PDT)
[AMBER] PROBLEM USING ANTECHAMBER
- Daniel Roe (Wed Oct 02 2013 - 08:50:26 PDT)
- Tanmoy Paul (Wed Oct 02 2013 - 05:36:47 PDT)
[AMBER] problem using the R.E.D server output
- Jason Swails (Mon Oct 21 2013 - 04:46:02 PDT)
- Bajarang Kumbhar (Mon Oct 21 2013 - 01:58:30 PDT)
[AMBER] problem with addIons in tleap
- David A Case (Tue Oct 01 2013 - 04:44:03 PDT)
[AMBER] problem with heme parameters bound to HIS
- case (Thu Oct 24 2013 - 13:17:54 PDT)
- moitrayee.mbu.iisc.ernet.in (Fri Oct 18 2013 - 09:37:15 PDT)
- case (Fri Oct 18 2013 - 08:10:42 PDT)
- moitrayee.mbu.iisc.ernet.in (Fri Oct 18 2013 - 02:05:48 PDT)
[AMBER] Protein-DNA covalent bond
- John Gehman (Sat Oct 12 2013 - 00:53:12 PDT)
- David A Case (Fri Oct 11 2013 - 07:39:12 PDT)
- John Gehman (Thu Oct 10 2013 - 17:51:55 PDT)
[AMBER] ptraj - loading list of frames
- Daniel Roe (Sat Oct 26 2013 - 13:48:57 PDT)
- Mark Healey (Sat Oct 26 2013 - 13:24:06 PDT)
[AMBER] PTRAJ - Problem with inserting TER card
- Daniel Roe (Fri Oct 18 2013 - 06:54:10 PDT)
- anu chandra (Thu Oct 17 2013 - 21:19:32 PDT)
- Daniel Roe (Thu Oct 17 2013 - 11:04:33 PDT)
- anu chandra (Wed Oct 16 2013 - 22:19:16 PDT)
- Daniel Roe (Wed Oct 16 2013 - 08:10:02 PDT)
- anu chandra (Wed Oct 16 2013 - 00:56:09 PDT)
[AMBER] Python script to reweight aMD simulations
- filip fratev (Wed Oct 16 2013 - 21:02:59 PDT)
[AMBER] QM/MM interfacing Gaussian
- case (Sat Oct 26 2013 - 06:01:05 PDT)
- Ahmed Ayoub (Sat Oct 26 2013 - 04:21:45 PDT)
[AMBER] QM/MM MMPBSA
- Jason Swails (Fri Oct 04 2013 - 06:59:18 PDT)
- Jason Swails (Fri Oct 04 2013 - 06:53:58 PDT)
- Jacopo Sgrignani (Fri Oct 04 2013 - 06:33:58 PDT)
- Jason Swails (Fri Oct 04 2013 - 05:34:34 PDT)
- Jacopo Sgrignani (Fri Oct 04 2013 - 05:15:39 PDT)
- Jason Swails (Fri Oct 04 2013 - 04:07:07 PDT)
- Jacopo Sgrignani (Fri Oct 04 2013 - 01:18:10 PDT)
[AMBER] Questions about softcore part
- David A Case (Thu Oct 10 2013 - 04:43:30 PDT)
- yuandandan (Thu Oct 10 2013 - 02:22:14 PDT)
[AMBER] Questions about VDW process of thermodynamic integration method
- 袁丹丹 (Thu Oct 03 2013 - 05:57:43 PDT)
[AMBER] Questions about VDW process of thermodynamic integration method‏
- 袁丹丹 (Thu Oct 03 2013 - 06:06:54 PDT)
[AMBER] Questions regarding AMBER
- Kamali Sripathi (Sun Oct 13 2013 - 15:04:04 PDT)
- FyD (Sun Oct 13 2013 - 09:44:11 PDT)
- Kamali Sripathi (Sun Oct 13 2013 - 07:31:04 PDT)
- FyD (Sun Oct 13 2013 - 07:05:20 PDT)
- Kamali Sripathi (Sun Oct 13 2013 - 06:01:20 PDT)
- David Case (Sat Oct 12 2013 - 08:39:09 PDT)
- Jiri Sponer (Sat Oct 12 2013 - 07:39:15 PDT)
- Kamali Sripathi (Sat Oct 12 2013 - 07:22:10 PDT)
[AMBER] ratio between frames for MM/PBSA and frames for normal mode calculations
- Thomas Evangelidis (Wed Oct 16 2013 - 16:10:54 PDT)
[AMBER] Reading NetCDF file
- Daniel Roe (Mon Oct 07 2013 - 13:25:15 PDT)
- Uday Midya (Fri Oct 04 2013 - 22:33:12 PDT)
- Daniel Roe (Fri Oct 04 2013 - 07:05:46 PDT)
- Jason Swails (Fri Oct 04 2013 - 06:18:12 PDT)
- Uday Midya (Fri Oct 04 2013 - 05:46:46 PDT)
[AMBER] RED-VIII.52 Problem--cannot find scratch file and punch file
- FyD (Thu Oct 10 2013 - 02:01:25 PDT)
- FyD (Thu Oct 10 2013 - 01:04:30 PDT)
- Dongshan Wei (Wed Oct 09 2013 - 05:50:33 PDT)
- FyD (Wed Oct 09 2013 - 00:09:44 PDT)
- FyD (Wed Oct 09 2013 - 00:03:20 PDT)
- Dongshan Wei (Tue Oct 08 2013 - 20:35:42 PDT)
- Dongshan Wei (Tue Oct 08 2013 - 08:37:10 PDT)
- FyD (Mon Sep 30 2013 - 22:35:43 PDT)
- Dongshan Wei (Mon Sep 30 2013 - 19:05:43 PDT)
- Dongshan Wei (Mon Sep 30 2013 - 10:56:42 PDT)
[AMBER] Regarding addition of DL_Poly Inversion and three body potential in Amber
- MOHD HOMAIDUR RAHMAN (Fri Oct 04 2013 - 10:09:02 PDT)
[AMBER] Regarding addition of DL_Poly Inversion potential in Amber
- Jason Swails (Sat Oct 05 2013 - 17:52:17 PDT)
- MOHD HOMAIDUR RAHMAN (Fri Oct 04 2013 - 05:17:33 PDT)
[AMBER] Regarding radial distribution function
- Daniel Roe (Thu Oct 24 2013 - 06:43:44 PDT)
- MOHD HOMAIDUR RAHMAN (Thu Oct 24 2013 - 04:46:48 PDT)
[AMBER] Replica exchange umbrella sampling
- Fabrício Bracht (Sat Oct 05 2013 - 00:29:29 PDT)
- Jason Swails (Fri Oct 04 2013 - 04:17:12 PDT)
- Fabrício Bracht (Fri Oct 04 2013 - 00:00:52 PDT)
[AMBER] RESP charge calculation problem for SO4 -2 group
- FyD (Wed Oct 16 2013 - 07:58:37 PDT)
- Bajarang Kumbhar (Wed Oct 16 2013 - 05:00:00 PDT)
[AMBER] rotational diffusion error
- Daniel Roe (Fri Oct 04 2013 - 07:11:19 PDT)
- Vijay Manickam Achari (Wed Oct 02 2013 - 19:06:38 PDT)
- David A Case (Wed Oct 02 2013 - 04:34:36 PDT)
- Vijay Manickam Achari (Tue Oct 01 2013 - 21:09:34 PDT)
- Vijay Manickam Achari (Tue Oct 01 2013 - 19:49:18 PDT)
[AMBER] running MMPBSA.py on an NMR ensemble
- Jason Swails (Sat Oct 12 2013 - 07:51:25 PDT)
- Thomas Evangelidis (Sat Oct 12 2013 - 06:50:54 PDT)
[AMBER] Running simultaneously AMBER jobs in CPU and GPU
- Jan-Philip Gehrcke (Fri Oct 18 2013 - 06:29:24 PDT)
- Muthukumaran R (Fri Oct 18 2013 - 04:24:54 PDT)
[AMBER] Sander error
- Jason Swails (Tue Oct 29 2013 - 13:55:36 PDT)
- Concha, Monica (Tue Oct 29 2013 - 13:39:09 PDT)
- Jason Swails (Tue Oct 29 2013 - 13:19:41 PDT)
- Concha, Monica (Tue Oct 29 2013 - 13:09:24 PDT)
[AMBER] Sander error (AmberTools 13 & Amber10)
- Daniel Roe (Thu Oct 31 2013 - 14:56:44 PDT)
- Concha, Monica (Thu Oct 31 2013 - 14:40:54 PDT)
- Daniel Roe (Thu Oct 31 2013 - 12:23:43 PDT)
- Concha, Monica (Thu Oct 31 2013 - 09:51:12 PDT)
- Daniel Roe (Thu Oct 31 2013 - 08:38:57 PDT)
- Concha, Monica (Thu Oct 31 2013 - 08:24:39 PDT)
[AMBER] Scaling of multi GPU runs
- Scott Le Grand (Tue Oct 08 2013 - 11:20:07 PDT)
- Ross Walker (Tue Oct 08 2013 - 11:13:40 PDT)
- Scott Le Grand (Tue Oct 08 2013 - 11:13:14 PDT)
- Ross Walker (Tue Oct 08 2013 - 11:02:45 PDT)
- peter.stauffert.boehringer-ingelheim.com (Tue Oct 08 2013 - 10:55:29 PDT)
[AMBER] Script?
- Daniel Roe (Tue Oct 22 2013 - 12:25:03 PDT)
- Beale, John (Tue Oct 22 2013 - 10:30:30 PDT)
[AMBER] Segmentation fault in tleap
- case (Fri Oct 11 2013 - 17:57:04 PDT)
- mmalett.nmt.edu (Fri Oct 11 2013 - 13:19:17 PDT)
- David A Case (Fri Oct 11 2013 - 10:27:12 PDT)
- mmalett.nmt.edu (Fri Oct 11 2013 - 09:15:15 PDT)
- David A Case (Fri Oct 11 2013 - 07:21:59 PDT)
- mmalett.nmt.edu (Thu Oct 10 2013 - 17:26:00 PDT)
- Jason Swails (Thu Oct 10 2013 - 17:19:34 PDT)
- mmalett.nmt.edu (Thu Oct 10 2013 - 16:53:58 PDT)
[AMBER] SHAKE flucatuation
- Thomas Cheatham (Thu Oct 10 2013 - 13:37:40 PDT)
- Zhiye Tang (Thu Oct 10 2013 - 13:33:21 PDT)
- Jason Swails (Thu Oct 10 2013 - 12:23:05 PDT)
- Thomas Cheatham (Thu Oct 10 2013 - 12:19:09 PDT)
- Zhiye Tang (Thu Oct 10 2013 - 11:54:30 PDT)
[AMBER] Shifting molecules by a box length
- Jason Swails (Wed Oct 09 2013 - 08:06:46 PDT)
- Heribert Reis (Wed Oct 09 2013 - 07:53:29 PDT)
[AMBER] Single quotes in AMBER manual
- case (Sat Oct 26 2013 - 06:02:27 PDT)
- Jonathan Sheehan (Fri Oct 25 2013 - 12:40:34 PDT)
[AMBER] Soft-core questions for TI method
- Ying-Chieh Sun (Wed Oct 30 2013 - 01:31:57 PDT)
- yuandandan (Mon Oct 07 2013 - 19:58:35 PDT)
- David A Case (Mon Oct 07 2013 - 05:21:19 PDT)
- yuandandan (Mon Oct 07 2013 - 00:43:29 PDT)
- yuandandan (Mon Oct 07 2013 - 00:26:16 PDT)
[AMBER] solvate box
- Jason Swails (Thu Oct 10 2013 - 09:08:55 PDT)
- Rasha Alqus (Thu Oct 10 2013 - 08:35:50 PDT)
[AMBER] strange behavior of MCPB
- Jia Xu (Wed Oct 16 2013 - 09:51:36 PDT)
- houcemeddine (Wed Oct 16 2013 - 08:50:03 PDT)
[AMBER] Stuck on AmberTools bugfix.23
- Terry M. Gray (Thu Oct 10 2013 - 14:52:14 PDT)
[AMBER] Stuck on AmberTools12 bug fix.23
- Jason Swails (Fri Oct 11 2013 - 04:20:11 PDT)
- Terry M. Gray (Thu Oct 10 2013 - 20:25:48 PDT)
[AMBER] sumit.saurav.jain.gmail.com has indicated you're a friend. Accept?
- sumit.saurav.jain.gmail.com (Sat Oct 05 2013 - 16:31:25 PDT)
[AMBER] Temperature based trajectory in REMD
- Daniel Roe (Wed Oct 02 2013 - 10:22:15 PDT)
- Gargi Borgohai (Wed Oct 02 2013 - 02:05:13 PDT)
[AMBER] Terachem tests with trial version
- Fabrício Bracht (Thu Oct 24 2013 - 00:12:26 PDT)
- Ross Walker (Wed Oct 23 2013 - 16:38:03 PDT)
- Fabrício Bracht (Wed Oct 23 2013 - 13:24:41 PDT)
- Andreas Goetz (Wed Oct 23 2013 - 10:38:40 PDT)
- Fabrício Bracht (Wed Oct 23 2013 - 00:21:47 PDT)
[AMBER] The Error when I run MdoutAnalysizer.py
- Biao Ma (Thu Oct 03 2013 - 22:36:48 PDT)
- Jason Swails (Thu Oct 03 2013 - 07:36:21 PDT)
- Jason Swails (Thu Oct 03 2013 - 04:33:41 PDT)
- Biao Ma (Wed Oct 02 2013 - 23:41:37 PDT)
[AMBER] TI soft-core parameters
- Hamed S. Hayatshahi (Thu Oct 31 2013 - 13:13:54 PDT)
[AMBER] tleap cannot handle dummies in the middle?
- Hannes Loeffler (Fri Oct 11 2013 - 09:18:43 PDT)
[AMBER] Trajectory determination and directionality in TI with softcore potentials
- Ying-Chieh Sun (Wed Oct 30 2013 - 01:43:06 PDT)
[AMBER] unique atoms in TI softcore
- case (Fri Oct 18 2013 - 08:07:47 PDT)
- Hannes Loeffler (Thu Oct 17 2013 - 07:42:58 PDT)
- David Case (Thu Oct 17 2013 - 04:45:04 PDT)
- Hannes Loeffler (Thu Oct 17 2013 - 03:01:11 PDT)
[AMBER] Update 21 for Amber 12: EXTERN QM/MM interface
- Andreas Goetz (Tue Oct 22 2013 - 15:44:03 PDT)
[AMBER] Use of Langevin Thermostat with Amoeba force field
- David A Case (Tue Oct 01 2013 - 04:34:24 PDT)
[AMBER] why are pres_X, pres_Y, and pres_Z different?
- Jose Borreguero (Mon Oct 28 2013 - 08:53:01 PDT)
- David A Case (Mon Oct 28 2013 - 08:40:00 PDT)
- Jose Borreguero (Mon Oct 28 2013 - 08:07:57 PDT)
- case (Fri Oct 25 2013 - 15:23:17 PDT)
- Jose Borreguero (Fri Oct 25 2013 - 08:42:02 PDT)
Fwd: DMPC GAFF lipid membrane is freezing at 303 K.
- Dickson, Callum (Mon Oct 28 2013 - 05:33:20 PDT)
- Subbarao Kanchi (Sun Oct 27 2013 - 17:39:15 PDT)
- Subbarao Kanchi (Fri Oct 18 2013 - 07:21:36 PDT)

Amber Archive Oct 2013 by subject