AMBER Archive (2002) - Sep 2002 By Author

244 messages sorted by: [ date ] [ thread ] [ subject ]
About this archive

Starting: Sun Sep 01 2002 - 13:32:08 CDT
Ending: Mon Sep 30 2002 - 19:34:28 CDT

A.Madhumalar
- parameters for sugars (Sun Sep 29 2002 - 11:30:36 CDT)
Alicia Hopkins
- Re: example 1 problems (Tue Sep 17 2002 - 07:03:53 CDT)
- example 1 problems (Mon Sep 16 2002 - 10:57:23 CDT)
amit kumar
- assistance required (Mon Sep 16 2002 - 11:25:05 CDT)
Andreas Svrcek-Seiler
- Re: offset of temperature when running MD with CAP and no periodic conditions (Thu Sep 19 2002 - 12:11:31 CDT)
Andrei Leitão
- Problems with poly(A)-poly(T) tutorial... (Mon Sep 30 2002 - 14:55:53 CDT)
Apostoluk, Wlodzimierz K
- divalent cations parameters (Mon Sep 30 2002 - 17:38:11 CDT)
- (no subject) (Wed Sep 25 2002 - 14:09:53 CDT)
Arvid Soederhaell
- ambpdb? (Wed Sep 25 2002 - 02:38:34 CDT)
Bayly, Christopher
- RE: antechamber best practices/charge equivalence w/ AM1-BCC (Tue Sep 24 2002 - 09:49:56 CDT)
C. Klein
- Re: old prmtop (Wed Sep 04 2002 - 11:21:18 CDT)
Carlos P. Sosa
- Re: problems on IBM AIX (Fri Sep 13 2002 - 10:47:31 CDT)
Carlos Simmerling
- Re: groups in targeted md (Mon Sep 30 2002 - 09:04:26 CDT)
- Re: Density during equilibration (sander) (Tue Sep 17 2002 - 20:44:13 CDT)
- Re: large energy fluctration (Thu Sep 12 2002 - 13:50:09 CDT)
- Re: sander.LES questions (Thu Sep 12 2002 - 12:24:25 CDT)
- Re: Strange MD simulation results with GB solvation at high temp. (Wed Sep 11 2002 - 21:04:44 CDT)
- Re: Strange MD simulation results with GB solvation at high temp. (Tue Sep 10 2002 - 07:07:58 CDT)
case
- RE: bondbydistance (Fri Sep 06 2002 - 19:04:02 CDT)
- RE: cut-off question (Fri Sep 06 2002 - 19:01:28 CDT)
- RE: Escaping Atoms (Thu Sep 05 2002 - 17:04:06 CDT)
ch cureton
- Torsion driving (Thu Sep 26 2002 - 11:00:34 CDT)
- Escaping Atoms (Wed Sep 04 2002 - 05:43:03 CDT)
Christoph Brockmann
- Re: groups in targeted md (Mon Sep 30 2002 - 09:48:16 CDT)
- groups in targeted md (Mon Sep 30 2002 - 08:15:10 CDT)
Cozmuta
- cut-off question (Fri Sep 06 2002 - 17:49:21 CDT)
CUI, Guanglei
- Re: a freeware to display RMSD matrices (Thu Sep 19 2002 - 08:42:29 CDT)
- Re: protein minimization (Tue Sep 03 2002 - 08:19:39 CDT)
darden
- Re: vlimit and vmax (Fri Sep 20 2002 - 14:27:10 CDT)
David A. Case
- Re: Image charges with the solvate cap command (Mon Sep 30 2002 - 19:34:28 CDT)
- Re: your mail (Mon Sep 30 2002 - 11:35:06 CDT)
- Re: Request for help with Antechamber (Fri Sep 27 2002 - 19:54:21 CDT)
- Re: nmanal help request (Fri Sep 27 2002 - 10:38:23 CDT)
- Re: Constant pressure equilibration in a system with a solvent cap (Fri Sep 27 2002 - 10:26:09 CDT)
- Re: mm_pbsa and statistic program (Thu Sep 26 2002 - 10:37:15 CDT)
- Re: GB tutorial (Thu Sep 26 2002 - 10:31:19 CDT)
- Re: Question about Antechamber (Thu Sep 26 2002 - 10:28:51 CDT)
- Re: expression of V(lambda) in GIBBS (Tue Sep 24 2002 - 09:14:01 CDT)
- Re: mm_pbsa (Mon Sep 23 2002 - 08:25:02 CDT)
- Re: mol2 file format in the future of amber (Sun Sep 22 2002 - 10:10:42 CDT)
- Re: Parameters for AMBER (Fri Sep 20 2002 - 08:53:18 CDT)
- Re: BLOWUP after 100 ns??? (Thu Sep 19 2002 - 19:29:58 CDT)
- Re: image (Thu Sep 19 2002 - 12:43:32 CDT)
- Re: bug in New2oldparm (Thu Sep 19 2002 - 10:28:30 CDT)
- Re: Density during equilibration (sander) (Tue Sep 17 2002 - 14:21:49 CDT)
- Re: SETVEL, incorrect number of arguments? (Tue Sep 17 2002 - 14:18:38 CDT)
- Re: example 1 problems (Tue Sep 17 2002 - 09:45:31 CDT)
- Re: question about nmode again. (Tue Sep 17 2002 - 09:40:00 CDT)
- Re: amber question (Mon Sep 16 2002 - 11:47:03 CDT)
- Re: example 1 problems (Mon Sep 16 2002 - 11:25:54 CDT)
- Re: problems on IBM AIX (Fri Sep 13 2002 - 09:42:14 CDT)
- Re: Distace dependent dielectric constant (Thu Sep 12 2002 - 17:39:35 CDT)
- Re: Strange MD simulation results with GB solvation at high temp. (Wed Sep 11 2002 - 20:20:17 CDT)
- Re: mm_pbsa positive binding energies (Mon Sep 02 2002 - 12:50:30 CDT)
David Smith
- Re: Constant pressure equilibration in a system with a solvent cap (Fri Sep 27 2002 - 11:11:19 CDT)
DeLano, Warren
- Periodicity Question (Fri Sep 20 2002 - 19:29:49 CDT)
- Dual Processor AMD vs. Single Processor (Wed Sep 11 2002 - 19:34:47 CDT)
- RE: PyMOL + AMBER Trajectories (Tue Sep 03 2002 - 12:51:57 CDT)
dianah_at_unm.edu
- Constant pressure equilibration in a system with a solvent cap (Thu Sep 26 2002 - 20:04:38 CDT)
dkeller_at_unm.edu
- Image charges with the solvate cap command (Mon Sep 30 2002 - 10:52:11 CDT)
Elsa de Sousa Henriques
- Re: parameters for sugars (Mon Sep 30 2002 - 11:42:24 CDT)
eric hu
- Re: large energy fluctration (Fri Sep 20 2002 - 13:00:17 CDT)
- large energy fluctration (Thu Sep 12 2002 - 13:05:10 CDT)
- bondbydistance (Thu Sep 05 2002 - 18:20:43 CDT)
Florian Barth
- Re: compiling amber on a linux box using DMEM-ALLOC (Fri Sep 06 2002 - 17:13:31 CDT)
Giovanni Fossati
- write problem on IBM-AIX (Mon Sep 30 2002 - 10:51:54 CDT)
- SETVEL, incorrect number of arguments? (Mon Sep 16 2002 - 17:43:30 CDT)
- problems on IBM AIX (Thu Sep 12 2002 - 20:43:52 CDT)
giudice
- Re: NTX value (Mon Sep 02 2002 - 02:05:45 CDT)
Giulio Rastelli
- memory allocation in mm_pbsa (Wed Sep 11 2002 - 05:41:04 CDT)
hagop demirdjian
- expression of V(lambda) in GIBBS (Tue Sep 24 2002 - 07:44:02 CDT)
Holger Gohlke
- Re: MM-PBSA basics (Sun Sep 29 2002 - 21:44:52 CDT)
- Re: mm_pbsa output error (Mon Sep 23 2002 - 23:21:30 CDT)
- Re: mm_pbsa (Sun Sep 22 2002 - 16:01:22 CDT)
- Re: betaP,SURFOFF inconsistency (Sun Sep 22 2002 - 15:20:03 CDT)
- Re: Do I have to rerun 1ns MD?? (Sun Sep 22 2002 - 14:30:40 CDT)
- Re: memory allocation in mm_pbsa (Wed Sep 11 2002 - 10:55:07 CDT)
- Re: why are the results so large difference calculating by mm_pbsa and mm_gbsa? (Tue Sep 10 2002 - 11:26:07 CDT)
- Re: nmode compile question? (Tue Sep 10 2002 - 11:17:24 CDT)
- Re: who to address this to?... (Mon Sep 09 2002 - 11:25:00 CDT)
- Re: DNA Tutorial Script (Wed Sep 04 2002 - 22:29:23 CDT)
- Re: old prmtop (Wed Sep 04 2002 - 11:21:32 CDT)
- Re: carnal averaging (Mon Sep 02 2002 - 15:43:52 CDT)
Ioana Cozmuta
- Re: Is H-bonding really there? (Fri Sep 27 2002 - 17:04:37 CDT)
- cut-off question (Wed Sep 04 2002 - 14:43:38 CDT)
- question (Tue Sep 03 2002 - 12:46:04 CDT)
- additional info (Sun Sep 01 2002 - 13:44:32 CDT)
- mpirun (Sun Sep 01 2002 - 13:32:08 CDT)
James W. Caldwell
- Partial charge generation RESP/antechamber (Mon Sep 30 2002 - 17:27:37 CDT)
- Re: Amber 7 and 6 topology files. (Mon Sep 30 2002 - 10:41:25 CDT)
- Re: Request for help with Antechamber (Sat Sep 28 2002 - 00:54:24 CDT)
- Re: Constant pressure equilibration in a system with a solvent cap (Fri Sep 27 2002 - 08:54:46 CDT)
- Amber Reflector (Thu Sep 26 2002 - 12:47:58 CDT)
- Re: compiling amber 7 with Intel Fortran Compiler 6.0 (Wed Sep 25 2002 - 15:58:04 CDT)
- Re: compiling amber 7 with Intel Fortran Compiler 6.0 (Wed Sep 25 2002 - 15:16:48 CDT)
- Mopac509mn/linux (Tue Sep 24 2002 - 10:00:20 CDT)
- Re: example 1 problems (Tue Sep 17 2002 - 09:24:30 CDT)
- Re: amber question (Mon Sep 16 2002 - 12:24:20 CDT)
- Re: D-tryptophan (Sat Sep 14 2002 - 10:21:42 CDT)
- Re: Qustion about calculation of pressure (Thu Sep 12 2002 - 11:43:25 CDT)
- Re: memory allocation in mm_pbsa (Wed Sep 11 2002 - 10:26:19 CDT)
- Re: loadpdb error messages (Tue Sep 10 2002 - 18:49:48 CDT)
- Re: nmode compile question? (Tue Sep 10 2002 - 13:04:07 CDT)
- Re: compiling amber on a linux box using DMEM-ALLOC (Fri Sep 06 2002 - 19:56:42 CDT)
Jessica Swanson
- who to address this to?... (Sun Sep 08 2002 - 17:59:23 CDT)
Jianhui Wu
- compile Moil-View, GL header files (Tue Sep 03 2002 - 10:20:09 CDT)
Joel Konkle-Parker
- MD Primers (Fri Sep 27 2002 - 14:54:03 CDT)
- Changing MAXINT (Thu Sep 12 2002 - 18:21:13 CDT)
- loadpdb error messages (Tue Sep 10 2002 - 17:58:07 CDT)
- DNA Tutorial Script (Wed Sep 04 2002 - 18:18:16 CDT)
Joffre Heredia
- rdparm (Tue Sep 10 2002 - 13:07:26 CDT)
John Bushnell
- compiling amber 7 with Intel Fortran Compiler 6.0 (fwd) (Wed Sep 25 2002 - 15:10:50 CDT)
- Re: Changing MAXINT (Fri Sep 13 2002 - 17:38:52 CDT)
- Re: compiling amber on a linux box using DMEM-ALLOC (Fri Sep 06 2002 - 18:43:12 CDT)
K.Seshadri
- amber7 compilation on irix6.4 mp (Mon Sep 09 2002 - 12:44:13 CDT)
K.Veluraja
- amber (Mon Sep 16 2002 - 00:14:04 CDT)
Kristina Furse
- RE: How to check whether the trajectory file matches the coordinates file or not? (Mon Sep 09 2002 - 14:32:27 CDT)
Lepsa
- Re: MM-PBSA basics (Mon Sep 30 2002 - 02:13:16 CDT)
- Re: ambpdb? (Wed Sep 25 2002 - 03:29:25 CDT)
- Fw: Do I have to rerun 1ns MD?? (Mon Sep 23 2002 - 10:50:26 CDT)
- Re: leap and topology file (Fri Sep 13 2002 - 09:39:45 CDT)
- Re: protein minimization (Tue Sep 03 2002 - 01:13:54 CDT)
Lifeng Tian
- Anal Error : Group (Fri Sep 27 2002 - 17:35:23 CDT)
Ling Zhang
- How to check whether the trajectory file matches the coordinates file or not? (Mon Sep 09 2002 - 13:31:13 CDT)
Lorenzo Gontrani
- Distace dependent dielectric constant (Mon Sep 09 2002 - 03:33:43 CDT)
M. L. Dodson
- Re: mol2 file format in the future of amber (Sun Sep 22 2002 - 10:34:06 CDT)
- mol2 file format in the future of amber (Fri Sep 20 2002 - 09:41:02 CDT)
m.elizabeth sophia
- protein minimization (Tue Sep 03 2002 - 11:01:35 CDT)
Mahadevan Seetharaman
- ISTAR2 - oops, just found the answer... (Wed Sep 25 2002 - 14:55:46 CDT)
- sander_classic: Recompile without ISTAR2 (Wed Sep 25 2002 - 14:53:59 CDT)
- Re: mm_pbsa (Sun Sep 22 2002 - 21:07:27 CDT)
Marc Dobler
- Re: Density during equilibration (sander) (Wed Sep 18 2002 - 02:11:21 CDT)
- Re: Density during equilibration (sander) (Tue Sep 17 2002 - 19:29:22 CDT)
Marcela Madrid
- leap and topology file (Thu Sep 12 2002 - 11:12:20 CDT)
Margaret Cheung
- Re: question about using 10-12 in amber7/sander. (Sat Sep 28 2002 - 15:35:48 CDT)
- question about using 10-12 in amber7/sander. (Sat Sep 28 2002 - 14:53:56 CDT)
Markus Drumm
- Question about Counterions (Thu Sep 19 2002 - 12:38:24 CDT)
Masaki Tomimoto
- Question about Antechamber (Wed Sep 25 2002 - 16:37:55 CDT)
Mathy Froeyen
- mm_pbsa positive binding energies (Mon Sep 02 2002 - 04:11:34 CDT)
Michael Crowley
- Re: who to address this to?... (Mon Sep 09 2002 - 12:41:16 CDT)
Michael Ford
- MM-PBSA basics (Fri Sep 27 2002 - 14:53:01 CDT)
Michael Murray
- mm_pbsa output error (Mon Sep 23 2002 - 12:26:11 CDT)
Michael Trieb
- watershell in ptraj (Tue Sep 24 2002 - 04:03:49 CDT)
Michal Otyepka
- Re: binding site volume (Fri Sep 13 2002 - 02:13:08 CDT)
- Polarizability, a general question (Wed Sep 11 2002 - 03:56:32 CDT)
Miguel de Federico
- Amber 7 and 6 topology files. (Mon Sep 30 2002 - 10:08:36 CDT)
Natasja Brooijmans
- Re: example 1 problems (Mon Sep 16 2002 - 11:40:38 CDT)
Nicholson, James D Mr ARO
- RE: Request for help with Antechamber (Fri Sep 27 2002 - 20:00:37 CDT)
- Request for help with Antechamber (Fri Sep 27 2002 - 18:58:58 CDT)
- Question on Antechamber paper (Thu Sep 26 2002 - 12:18:17 CDT)
- Help using moilview to make animations of trajectories (Fri Sep 13 2002 - 17:15:33 CDT)
- RE: bondbydistance (Sat Sep 07 2002 - 19:16:28 CDT)
Nikolai Smolin
- Qustion about calculation of pressure (Thu Sep 12 2002 - 05:01:44 CDT)
Pascal Bonnet
- mm_pbsa and statistic program (Thu Sep 26 2002 - 05:50:52 CDT)
- new2oldparm format (2) (Thu Sep 19 2002 - 05:43:39 CDT)
- bug in New2oldparm (Thu Sep 19 2002 - 05:35:46 CDT)
Perdita Barran
- D-tryptophan (Sat Sep 14 2002 - 09:16:45 CDT)
Peter Fojan
- nmanal help request (Fri Sep 27 2002 - 08:59:11 CDT)
Peter Gannett
- Re: MD Primers (Fri Sep 27 2002 - 18:34:40 CDT)
- Beowulf killing jobs (Fri Sep 13 2002 - 16:03:19 CDT)
- Re: old prmtop (Wed Sep 04 2002 - 13:10:56 CDT)
Peter Varnai
- ptraj-6.4/LES (Mon Sep 23 2002 - 04:18:25 CDT)
- sander.LES questions (Thu Sep 12 2002 - 11:27:12 CDT)
postmaster_at_96com.com
- MDaemon Warning - Virus Found (Fri Sep 13 2002 - 08:13:22 CDT)
- MDaemon Warning - Virus Found (Fri Sep 13 2002 - 08:10:40 CDT)
- MDaemon Warning - Virus Found (Tue Sep 10 2002 - 10:57:00 CDT)
- MDaemon Warning - Virus Found (Mon Sep 09 2002 - 06:04:45 CDT)
- MDaemon Warning - Virus Found (Fri Sep 06 2002 - 06:13:47 CDT)
- MDaemon Warning - Virus Found (Wed Sep 04 2002 - 05:40:26 CDT)
- MDaemon Warning - Virus Found (Tue Sep 03 2002 - 06:57:12 CDT)
- MDaemon Warning - Virus Found (Mon Sep 02 2002 - 06:25:18 CDT)
- MDaemon Warning - Virus Found (Mon Sep 02 2002 - 05:12:42 CDT)
Prabal Maiti
- ptraj rdf output (Fri Sep 20 2002 - 18:24:35 CDT)
Pratul Agarwal
- Re: Is H-bonding really there? (Fri Sep 27 2002 - 15:58:25 CDT)
- Re: Density during equilibration (sander) (Thu Sep 26 2002 - 09:09:02 CDT)
- RMSD for heavy atoms only (Wed Sep 25 2002 - 15:54:45 CDT)
- Re: Density during equilibration (sander) (Tue Sep 17 2002 - 19:22:22 CDT)
- Density during equilibration (sander) (Tue Sep 17 2002 - 11:56:10 CDT)
- Re: non-bonded metal ion in complex (Tue Sep 17 2002 - 08:59:14 CDT)
- Re: Problems during equilibration (Wed Sep 11 2002 - 21:40:05 CDT)
- Re: Problems during equilibration (Wed Sep 11 2002 - 15:14:05 CDT)
- Problems during equilibration (Wed Sep 11 2002 - 14:38:36 CDT)
- atoms coming too close during MD (with SHAKE on) (Mon Sep 02 2002 - 20:01:18 CDT)
Prem Raj
- vlimit and vmax (Fri Sep 20 2002 - 12:27:07 CDT)
- (no subject) (Fri Sep 20 2002 - 11:42:14 CDT)
- npairs (Thu Sep 19 2002 - 17:22:42 CDT)
- compiling without ISTAR2 (Thu Sep 19 2002 - 12:27:48 CDT)
Raik Grunberg
- GBSA and surface crystal waters (Tue Sep 10 2002 - 09:44:20 CDT)
- group selection for all heavy atoms ? (Fri Sep 06 2002 - 11:23:33 CDT)
Raja Swaminathan
- average structure (Thu Sep 05 2002 - 12:16:03 CDT)
ramon kleber da rocha
- compiling amber 7 with Intel Fortran Compiler 6.0 (Wed Sep 25 2002 - 14:23:21 CDT)
- Re: compiling amber on a linux box using DMEM-ALLOC (Fri Sep 06 2002 - 18:11:55 CDT)
- compiling amber on a linux box using DMEM-ALLOC (Fri Sep 06 2002 - 15:46:43 CDT)
Randy M. Wadkins
- Re: BLOWUP after 100 ns??? (Thu Sep 19 2002 - 20:41:16 CDT)
- Re: BLOWUP after 100 ns??? (Thu Sep 19 2002 - 16:39:48 CDT)
- BLOWUP after 100 ns??? (Thu Sep 19 2002 - 15:51:28 CDT)
Renee olano
- Re: compile Moil-View, GL header files (Tue Sep 03 2002 - 11:54:57 CDT)
Ross Walker
- RE: compiling without ISTAR2 (Thu Sep 19 2002 - 12:50:49 CDT)
- RE: Beowulf killing jobs (Mon Sep 16 2002 - 09:46:45 CDT)
- RE: Changing MAXINT (Mon Sep 16 2002 - 09:39:36 CDT)
- RE: mpirun (Sun Sep 01 2002 - 17:36:24 CDT)
Sanjeev B.S.
- Re: Carnal+HBond confusion (Tue Sep 24 2002 - 07:13:05 CDT)
- Carnal+HBond confusion (Wed Sep 18 2002 - 23:18:36 CDT)
- Re: ES40 hangs amber7 jobs. (Mon Sep 02 2002 - 21:29:45 CDT)
Scott Brozell
- Re: compiling amber 7 with Intel Fortran Compiler 6.0 (Wed Sep 25 2002 - 15:05:45 CDT)
- Re: compiling amber on a linux box using DMEM-ALLOC (Fri Sep 06 2002 - 19:16:40 CDT)
- Re: compiling amber on a linux box using DMEM-ALLOC (Fri Sep 06 2002 - 17:01:27 CDT)
Shixiang Yan
- binding site volume (Thu Sep 12 2002 - 18:38:41 CDT)
- Re: How to check whether the trajectory file matches the coordinates file or not? (Mon Sep 09 2002 - 13:53:04 CDT)
Soonmin Jang
- Re: Strange MD simulation results with GB solvation at high temp. (Fri Sep 13 2002 - 00:21:32 CDT)
- Re: Strange MD simulation results with GB solvation at high temp. (Tue Sep 10 2002 - 10:56:53 CDT)
- Strange MD simulation results with GB solvation at high temp. (Tue Sep 10 2002 - 05:09:06 CDT)
Sophia Kondratova
- ptraj - BONDS_WITHOUT_HYDROGEN (Wed Sep 25 2002 - 11:54:48 CDT)
Stéphane Teletchéa
- Re: Dual Processor AMD vs. Single Processor (Thu Sep 12 2002 - 03:09:58 CDT)
Sue Heavner
- mm_pbsa (Fri Sep 20 2002 - 15:00:36 CDT)
- Z DNA (Tue Sep 17 2002 - 14:55:04 CDT)
suvendu lomash
- BondEn shoots in solvent minimization (Mon Sep 30 2002 - 10:50:39 CDT)
- Is H-bonding really there? (Fri Sep 27 2002 - 14:59:48 CDT)
Therese Malliavin
- offset of temperature when running MD with CAP and no periodic conditions (Thu Sep 19 2002 - 10:44:24 CDT)
Thomas Cheatham
- Re: Is H-bonding really there? (Fri Sep 27 2002 - 15:53:24 CDT)
- Re: watershell in ptraj (Tue Sep 24 2002 - 14:28:09 CDT)
- Re: vlimit and vmax (Fri Sep 20 2002 - 14:14:11 CDT)
- Re: Dynamic Movement of Molecule (Fri Sep 20 2002 - 14:01:39 CDT)
Thomas Steinbrecher
- old prmtop (Wed Sep 04 2002 - 10:56:47 CDT)
Tom Bishop
- antechamber best practices/charge equivalence w/ AM1-BCC (Mon Sep 23 2002 - 16:28:57 CDT)
Viktor Hornak
- Re: compile Moil-View, GL header files (Tue Sep 03 2002 - 11:12:22 CDT)
Vlad Cojocaru
- different counterions for special type of DNA (Thu Sep 26 2002 - 07:59:31 CDT)
- a freeware to display RMSD matrices (Thu Sep 19 2002 - 07:44:53 CDT)
- the amino group of 2amino purine has strange behaviour (Thu Sep 12 2002 - 13:42:10 CDT)
- sorry this is just a test (Thu Sep 12 2002 - 10:23:24 CDT)
- just a test (Wed Sep 11 2002 - 08:39:59 CDT)
- parameterization of a new class of compounds (nucleic acid base analogues) (Mon Sep 09 2002 - 04:40:05 CDT)
- carnal averaging (Mon Sep 02 2002 - 06:43:33 CDT)
wentaofu
- mm_pbsa question. (Tue Sep 17 2002 - 10:35:59 CDT)
X. Tan
- image (Thu Sep 19 2002 - 12:32:15 CDT)
- how to detect bad contact? (Wed Sep 04 2002 - 14:14:40 CDT)
yao yong
- amber question (Mon Sep 16 2002 - 06:03:16 CDT)
Yongjun Jiang
- question about nmode again. (Tue Sep 17 2002 - 02:15:54 CDT)
- why are the results so large difference calculating by mm_pbsaandmm_gbsa? (Thu Sep 12 2002 - 02:25:32 CDT)
- nmode compile question? (Tue Sep 10 2002 - 07:46:18 CDT)
- why are the results so large difference calculating by mm_pbsa and mm_gbsa? (Tue Sep 10 2002 - 02:18:46 CDT)
yuann
- non-bonded metal ion in complex (Tue Sep 17 2002 - 01:28:45 CDT)
Yuuki Komata
- Dynamic Movement of Molecule (Fri Sep 20 2002 - 03:03:48 CDT)
Zhang Jian
- about amber and charmm, thanks (Sun Sep 08 2002 - 04:10:57 CDT)

Last message date: Tue Dec 31 2002 - 15:51:31 CST
Archived on: Thu May 05 2005 - 14:17:26 CDT

244 messages sorted by: [ date ] [ thread ] [ subject ]
About this archive