AMBER Archive (2003) - Feb 2003 By DateMost recent messages
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About this archive
Starting: Sat Feb 01 2003 - 13:22:16 CST
Ending: Fri Feb 28 2003 - 20:29:29 CST
- Gibbs stops after a finite number of window runs Seongeun Yang (Sat Feb 01 2003 - 13:22:16 CST)
- Re: Gibbs stops after a finite number of window runs David A. Case (Sat Feb 01 2003 - 15:11:43 CST)
- Re: Gibbs stops after a finite number of window runs Seongeun Yang (Sat Feb 01 2003 - 15:42:42 CST)
- Re: Gibbs stops after a finite number of window runs caldwell_at_heimdal.compchem.ucsf.edu (Sat Feb 01 2003 - 16:42:54 CST)
- Re: question about ligand Lishan Yao (Sat Feb 01 2003 - 20:24:57 CST)
- gibbs input file Patricia Burgess (Sun Feb 02 2003 - 18:01:59 CST)
- questions about AMBER Guoxi Zhang (Sun Feb 02 2003 - 20:57:21 CST)
- How to calculate new force field? k.watanabe (Mon Feb 03 2003 - 01:22:31 CST)
- some questions in gibbs calculation Xiang, Tian-Xiang (Mon Feb 03 2003 - 07:46:39 CST)
- question about temperature Lishan Yao (Mon Feb 03 2003 - 11:02:13 CST)
- Neutral ARG Osmar Norberto de Souza (Mon Feb 03 2003 - 11:19:02 CST)
- Re: question about temperature Carlos Simmerling (Mon Feb 03 2003 - 11:31:28 CST)
- boron parameters Fabian Boes (Mon Feb 03 2003 - 11:51:20 CST)
- Re: How to calculate new force field? Jose Ramon Blas (Mon Feb 03 2003 - 13:06:24 CST)
- SASA calculation Luis Gracia (Mon Feb 03 2003 - 16:58:25 CST)
- Re: SASA calculation Michael Ford (Mon Feb 03 2003 - 17:22:26 CST)
- trajectory file in mm_pbsa eric hu (Mon Feb 03 2003 - 20:11:21 CST)
- desolvation energy in mm_pbsa eric hu (Mon Feb 03 2003 - 20:36:44 CST)
- Acetonitrile parameters N. Jiten Singh (Mon Feb 03 2003 - 23:52:16 CST)
- MM-PBSA error Bimo Ario Tejo (Mon Feb 03 2003 - 23:56:34 CST)
- Ptraj problem with small molecules Dvira Segal (Tue Feb 04 2003 - 08:18:11 CST)
- Re: desolvation energy in mm_pbsa Michael Ford (Tue Feb 04 2003 - 08:21:15 CST)
- Amber7 & mpich FyD (Tue Feb 04 2003 - 08:27:23 CST)
- Re: some questions in gibbs calculation David A. Case (Tue Feb 04 2003 - 09:16:40 CST)
- Re: Ptraj problem with small molecules David A. Case (Tue Feb 04 2003 - 09:20:54 CST)
- Re: Acetonitrile parameters Pascal Bonnet (Tue Feb 04 2003 - 09:22:04 CST)
- ifc, gibbs and ewald David Smith (Tue Feb 04 2003 - 10:49:53 CST)
- RESP charge derivation Lepsa (Tue Feb 04 2003 - 11:34:57 CST)
- [Fwd: Re: trajectory file in mm_pbsa] Holger Gohlke (Tue Feb 04 2003 - 11:47:08 CST)
- Re: Amber7 & mpich Michael Crowley (Tue Feb 04 2003 - 11:56:22 CST)
- Re: Amber7 & mpich Viktor Hornak (Tue Feb 04 2003 - 12:07:47 CST)
- Re: acetonitrile parameters Jose Ramon Blas (Tue Feb 04 2003 - 13:21:39 CST)
- Re: desolvation energy in mm_pbsa eric hu (Tue Feb 04 2003 - 14:38:18 CST)
- Re: desolvation energy in mm_pbsa Holger Gohlke (Tue Feb 04 2003 - 14:59:21 CST)
- Re: Amber7 & mpich Florian Barth (Tue Feb 04 2003 - 17:39:51 CST)
- How to do the image using ptraj? Yuhui Cheng (Tue Feb 04 2003 - 20:35:53 CST)
- Re: MM-PBSA error Bimo Ario Tejo (Tue Feb 04 2003 - 21:05:30 CST)
- bond command Craig A Bayse (Tue Feb 04 2003 - 23:46:20 CST)
- Re: bond command David A. Case (Wed Feb 05 2003 - 00:30:26 CST)
- Fw: RESP charge derivation Lepsa (Wed Feb 05 2003 - 02:33:53 CST)
- stacking energy thenmalar rathinavelan (Wed Feb 05 2003 - 04:19:06 CST)
- Re: Amber7 & mpich FyD (Wed Feb 05 2003 - 08:58:25 CST)
- about Mg++ Lishan Yao (Wed Feb 05 2003 - 11:17:12 CST)
- noninteger charge eric hu (Wed Feb 05 2003 - 12:03:08 CST)
- Re: noninteger charge David A. Case (Wed Feb 05 2003 - 12:59:32 CST)
- Re: bond command Craig A Bayse (Wed Feb 05 2003 - 15:30:36 CST)
- Re: bond command David A. Case (Thu Feb 06 2003 - 00:13:22 CST)
- Gibbs: DynamicWin and NSTMEQ? Paula Petrone (Thu Feb 06 2003 - 12:48:02 CST)
- Carnal problem... Andrei Leit鉶 (Thu Feb 06 2003 - 16:17:49 CST)
- Misaligned Coords from Alanine Scanning Robert J. Woods (Fri Feb 07 2003 - 09:54:07 CST)
- Re: Misaligned Coords from Alanine Scanning Holger Gohlke (Fri Feb 07 2003 - 10:00:31 CST)
- essential dynamics Lishan Yao (Fri Feb 07 2003 - 10:31:05 CST)
- Re: essential dynamics Yongxing Liu (Fri Feb 07 2003 - 12:13:09 CST)
- Carnal DECLARE of TORSION problem William Wei (Fri Feb 07 2003 - 12:20:37 CST)
- Re: Carnal DECLARE of TORSION problem Holger Gohlke (Fri Feb 07 2003 - 12:34:07 CST)
- Re: essential dynamics David A. Case (Fri Feb 07 2003 - 15:19:04 CST)
- mpi/sander help Thu Zar Lwin (Fri Feb 07 2003 - 16:01:05 CST)
- Re: mpi/sander help Michael Crowley (Fri Feb 07 2003 - 16:05:10 CST)
- Backbone torsional angles' format? William Wei (Fri Feb 07 2003 - 17:35:56 CST)
- Re: Gibbs: DynamicWin and NSTMEQ? David A. Case (Fri Feb 07 2003 - 18:12:07 CST)
- [Fwd: Re: Backbone torsional angles' format?] Holger Gohlke (Fri Feb 07 2003 - 18:23:15 CST)
- Periodic Box John Finke (Fri Feb 07 2003 - 18:25:10 CST)
- Re: Backbone torsional angles' format? Bill Ross (Fri Feb 07 2003 - 22:01:26 CST)
- RE: Periodic Box Xiang, Tian-Xiang (Sat Feb 08 2003 - 10:52:49 CST)
- energy calculation thenmalar rathinavelan (Sun Feb 09 2003 - 01:19:59 CST)
- Re: energy calculation Carlos Simmerling (Sun Feb 09 2003 - 07:27:03 CST)
- RE: energy calculation Yong Duan (Sun Feb 09 2003 - 10:36:28 CST)
- Question about quasih Lishan Yao (Sun Feb 09 2003 - 17:18:38 CST)
- Re: Question about quasih CUI, Guanglei (Sun Feb 09 2003 - 20:59:11 CST)
- decrease a force const. for angle Michal Otyepka (Mon Feb 10 2003 - 06:47:35 CST)
- mm_pbsa energy unit eric hu (Mon Feb 10 2003 - 13:22:38 CST)
- Internal dielectric in MM-GBSA Robert J. Woods (Mon Feb 10 2003 - 13:29:36 CST)
- Re: mm_pbsa energy unit Holger Gohlke (Mon Feb 10 2003 - 13:48:51 CST)
- force field problem Bayly, Christopher (Mon Feb 10 2003 - 14:01:37 CST)
- Re: Internal dielectric in MM-GBSA David A. Case (Mon Feb 10 2003 - 14:29:44 CST)
- AMBER mail reflector archive Jarrod Smith (Mon Feb 10 2003 - 14:37:09 CST)
- Re: decrease a force const. for angle David A. Case (Mon Feb 10 2003 - 19:04:55 CST)
- UCSF moving day. caldwell_at_heimdal.compchem.ucsf.edu (Mon Feb 10 2003 - 19:29:07 CST)
- references Ioana Cozmuta (Mon Feb 10 2003 - 20:22:51 CST)
- Itanium II Jose Ramon Blas (Tue Feb 11 2003 - 12:50:58 CST)
- MM_PBSA Errors Ram髇 Gardu駉-Ju醨ez (Tue Feb 11 2003 - 18:16:00 CST)
- NTC=3 for organic solvent and NTC=2 for soluter? yuan bo (Wed Feb 12 2003 - 03:57:21 CST)
- NTC=3 for organic solvent and NTC=2 for solute? yuan bo (Wed Feb 12 2003 - 03:57:42 CST)
- Re: MM_PBSA Errors Pascal Bonnet (Wed Feb 12 2003 - 03:50:23 CST)
- hexane parameters pu xuemei (Wed Feb 12 2003 - 04:00:19 CST)
- Error Massage in Sander amber7 in Linux N. Jiten Singh (Wed Feb 12 2003 - 07:07:26 CST)
- Re: Error Massage in Sander amber7 in Linux David A. Case (Wed Feb 12 2003 - 07:22:55 CST)
- Re: Re: Error Massage in Sander amber7 in Linux N. Jiten Singh (Wed Feb 12 2003 - 08:13:17 CST)
- How to put the outside atoms back to the truncated octahedron box? Ling Zhang (Wed Feb 12 2003 - 13:49:12 CST)
- Re: How to put the outside atoms back to the truncated octahedron box? Natasja Brooijmans (Wed Feb 12 2003 - 14:00:50 CST)
- question about antechamber Lishan Yao (Wed Feb 12 2003 - 14:06:23 CST)
- amber web site Steve Seibold (Wed Feb 12 2003 - 14:30:40 CST)
- The image command of ptraj of Amber 6 is not working. Ling Zhang (Wed Feb 12 2003 - 14:36:58 CST)
- delphi and charge file Sue Heavner (Wed Feb 12 2003 - 14:49:01 CST)
- Re: amber web site Mengjuei Hsieh (Wed Feb 12 2003 - 14:59:11 CST)
- RE: amber web site Ross Walker (Wed Feb 12 2003 - 15:13:07 CST)
- Re: bond command Craig A Bayse (Wed Feb 12 2003 - 15:36:29 CST)
- Re: The image command of ptraj of Amber 6 is not working. Thomas Cheatham (Wed Feb 12 2003 - 15:40:28 CST)
- Re: Error Massage in Sander amber7 in Linux John Bushnell (Wed Feb 12 2003 - 15:49:56 CST)
- Re: delphi and charge file Holger Gohlke (Wed Feb 12 2003 - 16:43:39 CST)
- RE: Itanium II Ross Walker (Wed Feb 12 2003 - 17:46:27 CST)
- RE: Itanium II Scott Brozell (Wed Feb 12 2003 - 18:21:06 CST)
- Including the Peroidiic Box info ?? N. Jiten Singh (Wed Feb 12 2003 - 21:21:41 CST)
- About antechamber k.watanabe (Wed Feb 12 2003 - 23:32:18 CST)
- Isotropic Solvent Box N. Jiten Singh (Thu Feb 13 2003 - 05:28:55 CST)
- compatibility of amber with NAMD Ioana Cozmuta (Thu Feb 13 2003 - 12:42:41 CST)
- xleap crash under Irix FyD (Thu Feb 13 2003 - 13:46:07 CST)
- Re: xleap crash under Irix David A. Case (Thu Feb 13 2003 - 14:57:35 CST)
- Re: compatibility of amber with NAMD Peter Gannett (Thu Feb 13 2003 - 16:05:54 CST)
- inter & intra-molecular interaction energies Tian-Xiang Xiang (Thu Feb 13 2003 - 16:10:07 CST)
- question about antechamber Lishan Yao (Thu Feb 13 2003 - 16:55:39 CST)
- Re: inter & intra-molecular interaction energies David A. Case (Thu Feb 13 2003 - 17:21:15 CST)
- web page update caldwell_at_heimdal.compchem.ucsf.edu (Thu Feb 13 2003 - 17:34:45 CST)
- RE: inter & intra-molecular interaction energies Xiang, Tian-Xiang (Thu Feb 13 2003 - 17:47:54 CST)
- Re: bond command David A. Case (Fri Feb 14 2003 - 00:38:09 CST)
- Postdoctoral position available in Molecular Modeling Nicolas Le Novere (Fri Feb 14 2003 - 04:27:56 CST)
- Re: compatibility of amber with NAMD Andreas Svrcek-Seiler (Fri Feb 14 2003 - 08:27:27 CST)
- Re: compatibility of amber with NAMD Luis Gracia (Fri Feb 14 2003 - 12:16:12 CST)
- charge determination for polariable ff02 force fields Xiang, Tian-Xiang (Fri Feb 14 2003 - 14:27:51 CST)
- MAXINT problem yuan bo (Fri Feb 14 2003 - 23:51:13 CST)
- charges, opt and iops Lepsa (Sat Feb 15 2003 - 09:59:44 CST)
- Fw: charge determination for polariable ff02 force fields Lepsa (Sat Feb 15 2003 - 10:12:02 CST)
- TAUP and density problem yuan bo (Sun Feb 16 2003 - 03:29:34 CST)
- (no subject) Majid moghaddam (Sun Feb 16 2003 - 07:57:21 CST)
- RE: charge determination for polariable ff02 force fields Xiang, Tian-Xiang (Sun Feb 16 2003 - 12:19:39 CST)
- question on EWALD Sichun Yang (Sun Feb 16 2003 - 17:54:49 CST)
- RE: TAUP and density problem case (Sun Feb 16 2003 - 19:36:48 CST)
- Re: charge determination for polariable ff02 force fields Lepsa (Mon Feb 17 2003 - 02:16:07 CST)
- RE:RE: TAUP and density problem yuan bo (Mon Feb 17 2003 - 03:50:08 CST)
- Number of water too large kalyan_at_mbu.iisc.ernet.in (Mon Feb 17 2003 - 10:10:52 CST)
- Velocity A. Hungie (Mon Feb 17 2003 - 10:01:04 CST)
- Re: Velocity caldwell_at_heimdal.compchem.ucsf.edu (Mon Feb 17 2003 - 10:10:06 CST)
- Re: Velocity Carlos Simmerling (Mon Feb 17 2003 - 12:02:34 CST)
- Re: RE: TAUP and density problem David A. Case (Mon Feb 17 2003 - 12:06:03 CST)
- Re: question on EWALD David A. Case (Mon Feb 17 2003 - 12:08:53 CST)
- Re: question on EWALD Sichun Yang (Mon Feb 17 2003 - 13:16:25 CST)
- Re: question on EWALD Sichun Yang (Mon Feb 17 2003 - 13:37:04 CST)
- Amber Documents Nicole A Rutkowski (Mon Feb 17 2003 - 13:42:26 CST)
- RE: Velocity Yong Duan (Mon Feb 17 2003 - 15:00:01 CST)
- RE: question on EWALD Yong Duan (Mon Feb 17 2003 - 15:08:17 CST)
- RE: question on EWALD Sichun Yang (Mon Feb 17 2003 - 16:12:42 CST)
- RE: question on EWALD Yong Duan (Mon Feb 17 2003 - 16:54:14 CST)
- RE: question on EWALD Sichun Yang (Mon Feb 17 2003 - 17:28:00 CST)
- one time evaluation Ioana Cozmuta (Mon Feb 17 2003 - 18:14:32 CST)
- question about partial charge yuann (Mon Feb 17 2003 - 20:43:48 CST)
- Re: question about partial charge Lepsa (Tue Feb 18 2003 - 01:56:59 CST)
- metallic ions Marc Dobler (Tue Feb 18 2003 - 03:10:29 CST)
- interaction between ligand & protein Lishan Yao (Tue Feb 18 2003 - 10:59:56 CST)
- Re: interaction between ligand & protein Lepsa (Tue Feb 18 2003 - 11:28:35 CST)
- Gibbs: Electrostatic Decoupling Paula Petrone (Tue Feb 18 2003 - 11:31:41 CST)
- adding hydrogens CUI, Guanglei (Tue Feb 18 2003 - 12:44:13 CST)
- charge neutralization in DNA Mahadevan Seetharaman (Tue Feb 18 2003 - 13:08:55 CST)
- File in the tutorial Alexei Valiaev (Tue Feb 18 2003 - 17:18:05 CST)
- Final energy minimization step Andrei Leit鉶 (Tue Feb 18 2003 - 14:30:08 CST)
- restrained atoms NTR Sichun Yang (Tue Feb 18 2003 - 15:45:33 CST)
- Re: (no subject) David A. Case (Tue Feb 18 2003 - 16:16:34 CST)
- Re: File in the tutorial David A. Case (Tue Feb 18 2003 - 16:19:24 CST)
- Re: Final energy minimization step David A. Case (Tue Feb 18 2003 - 16:25:05 CST)
- Re: charge neutralization in DNA David A. Case (Tue Feb 18 2003 - 16:27:20 CST)
- mm_pbsa Yongmei Wang (Tue Feb 18 2003 - 17:14:01 CST)
- Re: mm_pbsa Holger Gohlke (Tue Feb 18 2003 - 18:13:51 CST)
- bugfix.33 not online chernhoe (Tue Feb 18 2003 - 19:45:12 CST)
- Re: question about partial charge sychen (Tue Feb 18 2003 - 21:52:32 CST)
- Re: restrained atoms NTR David A. Case (Tue Feb 18 2003 - 22:16:50 CST)
- Re: adding hydrogens Oliver Hucke (Wed Feb 19 2003 - 02:02:30 CST)
- Re: adding hydrogens Lepsa (Wed Feb 19 2003 - 02:26:36 CST)
- How do NTC=2 recognize hydrogen atom? yuan bo (Wed Feb 19 2003 - 04:24:55 CST)
- hexane parameters pu xuemei (Wed Feb 19 2003 - 06:06:50 CST)
- RE: adding hydrogens CUI, Guanglei (Wed Feb 19 2003 - 08:06:27 CST)
- Fw: adding hydrogens Lepsa (Wed Feb 19 2003 - 08:23:54 CST)
- Re: restrained atoms NTR Sichun Yang (Wed Feb 19 2003 - 11:27:18 CST)
- no statistics.out in mm_pbsa binding energy calculations eric hu (Wed Feb 19 2003 - 12:27:10 CST)
- Re: no statistics.out in mm_pbsa binding energy calculations Holger Gohlke (Wed Feb 19 2003 - 12:48:59 CST)
- antechamber and its prepin files Steve Seibold (Wed Feb 19 2003 - 13:11:23 CST)
- Re: antechamber and its prepin files David A. Case (Wed Feb 19 2003 - 15:08:55 CST)
- Web site problems. caldwell_at_heimdal.compchem.ucsf.edu (Wed Feb 19 2003 - 15:47:11 CST)
- Energy calculation Sichun Yang (Wed Feb 19 2003 - 16:25:45 CST)
- Re: Energy calculation Holger Gohlke (Wed Feb 19 2003 - 16:54:30 CST)
- Minimization after dynamic? Andrei Leit鉶 (Wed Feb 19 2003 - 18:13:31 CST)
- Re: Energy calculation Sichun Yang (Wed Feb 19 2003 - 20:51:11 CST)
- Nmode thenmalar rathinavelan (Thu Feb 20 2003 - 00:21:03 CST)
- Re: How do NTC=2 recognize hydrogen atom? David A. Case (Thu Feb 20 2003 - 10:19:27 CST)
- Re: Nmode Holger Gohlke (Thu Feb 20 2003 - 12:35:57 CST)
- probelms with antechamber Yongmei Wang (Thu Feb 20 2003 - 14:09:44 CST)
- Re: probelms with antechamber David A. Case (Thu Feb 20 2003 - 19:19:24 CST)
- AMBER6 problem in Solaris 8 S.Swaminathan (Fri Feb 21 2003 - 13:18:19 CST)
- Re: AMBER6 problem in Solaris 8 David A. Case (Fri Feb 21 2003 - 01:56:21 CST)
- about urea and glycerol Nikolai Smolin (Fri Feb 21 2003 - 05:04:33 CST)
- unsubscribe Xiang Mao (Fri Feb 21 2003 - 09:29:28 CST)
- minimization with fixed UC dimensions Ioana Cozmuta (Fri Feb 21 2003 - 13:38:01 CST)
- Re: minimization with fixed UC dimensions David A. Case (Fri Feb 21 2003 - 14:00:09 CST)
- failure of minimization Ioana Cozmuta (Fri Feb 21 2003 - 19:10:37 CST)
- Re: minimization with fixed UC dimensions Ioana Cozmuta (Fri Feb 21 2003 - 19:24:32 CST)
- RE: failure of minimization Yong Duan (Fri Feb 21 2003 - 20:34:04 CST)
- 永嘉瓯北上明阀门厂 by (Sat Feb 22 2003 - 23:49:08 CST)
- new-style prmtop file chernhoe (Sun Feb 23 2003 - 21:45:46 CST)
- Binary output switch (IOUTFM=1) broken in sander? (AMBER7) John D. Chodera (Sun Feb 23 2003 - 22:49:56 CST)
- Re: new-style prmtop file David A. Case (Sun Feb 23 2003 - 23:38:29 CST)
- Re: new-style prmtop file chernhoe (Mon Feb 24 2003 - 00:48:47 CST)
- GB/SA Franck Chevalier (Mon Feb 24 2003 - 03:04:22 CST)
- Force field ? Subba.Raju (Mon Feb 24 2003 - 04:17:54 CST)
- a question~~ resister_at_pchome.com.tw (Mon Feb 24 2003 - 18:28:52 CST)
- RE: failure of minimization Ioana Cozmuta (Mon Feb 24 2003 - 13:33:58 CST)
- RE: failure of minimization Ioana Cozmuta (Mon Feb 24 2003 - 17:11:23 CST)
- RE: failure of minimization Yong Duan (Mon Feb 24 2003 - 19:42:14 CST)
- adjust virial Ioana Cozmuta (Tue Feb 25 2003 - 02:15:45 CST)
- problem patch files chernhoe (Tue Feb 25 2003 - 02:15:44 CST)
- ptraj residue number out of range Giulio Rastelli (Tue Feb 25 2003 - 11:20:30 CST)
- Compilation error of Amber 7 using pgi and mpich on Linux Cluster Fabrice Yerly (Tue Feb 25 2003 - 07:02:00 CST)
- Info request: Amber on 64-bit CPUs Daniel Svozil (Tue Feb 25 2003 - 07:34:57 CST)
- Re: Compilation error of Amber 7 using pgi and mpich on Linux Cluster Tormod Skauge (Tue Feb 25 2003 - 09:00:19 CST)
- Re: Info request: Amber on 64-bit CPUs Chuck Schneider (Tue Feb 25 2003 - 09:02:49 CST)
- Re: ptraj residue number out of range Holger Gohlke (Tue Feb 25 2003 - 10:24:00 CST)
- Re: ptraj residue number out of range Giulio Rastelli (Tue Feb 25 2003 - 17:35:24 CST)
- Re: ptraj residue number out of range Holger Gohlke (Tue Feb 25 2003 - 11:31:14 CST)
- Re: Info request: Amber on 64-bit CPUs Carlos P. Sosa (Tue Feb 25 2003 - 11:43:23 CST)
- (no subject) Robert Cave (Tue Feb 25 2003 - 13:55:51 CST)
- Re: Amber under Linux Scott Brozell (Tue Feb 25 2003 - 15:13:11 CST)
- EXTRA_PTS: frtype 2 Should not be here Artem Mamonov (Tue Feb 25 2003 - 16:09:56 CST)
- Re: EXTRA_PTS: frtype 2 Should not be here Artem Mamonov (Tue Feb 25 2003 - 17:49:42 CST)
- Re: AMBER6 problem in Solaris 8 S.Swaminathan (Wed Feb 26 2003 - 12:10:56 CST)
- Re: AMBER6 problem in Solaris 8 Sanjeev B.S. (Tue Feb 25 2003 - 23:03:55 CST)
- mm_pbsa Layi Adekoya (Wed Feb 26 2003 - 04:05:35 CST)
- Analysis of close waters Markus Drumm (Wed Feb 26 2003 - 06:23:25 CST)
- Re: mm_pbsa Lepsa (Wed Feb 26 2003 - 06:41:47 CST)
- Namelist READ error Thomas Steinbrecher (Wed Feb 26 2003 - 06:54:46 CST)
- Re: Namelist READ error - solved Thomas Steinbrecher (Wed Feb 26 2003 - 08:54:54 CST)
- Automated response taxquestions_at_nyit.edu (Wed Feb 26 2003 - 11:11:58 CST)
- results of MD comparison Xiaoqin Huang (Wed Feb 26 2003 - 09:08:59 CST)
- Re: results of MD comparison Carlos Simmerling (Wed Feb 26 2003 - 15:00:20 CST)
- question about lysine? Lishan Yao (Wed Feb 26 2003 - 16:23:38 CST)
- Re: question about lysine? Guanglei Cui (Wed Feb 26 2003 - 21:20:43 CST)
- Re: Analysis of close waters Markus Drumm (Thu Feb 27 2003 - 06:24:13 CST)
- extract coord and velocities sara nunez (Thu Feb 27 2003 - 06:55:18 CST)
- stress - strain - pressure seraphimo_at_gmx.de (Thu Feb 27 2003 - 07:06:32 CST)
- nmode on Linux : another memory question E.S. (Thu Feb 27 2003 - 16:42:15 CST)
- Beyond 1,000,000 atoms... Vlad (Thu Feb 27 2003 - 19:45:14 CST)
- seperate one trajectory file into two eric hu (Thu Feb 27 2003 - 21:02:58 CST)
- Re: seperate one trajectory file into two Holger Gohlke (Thu Feb 27 2003 - 21:45:50 CST)
- protein dna simulation chernhoe (Thu Feb 27 2003 - 22:13:58 CST)
- how to validate ff parameters obtained from antechamber Jiyoung Heo (Thu Feb 27 2003 - 23:27:54 CST)
- Re: GB/SA David A. Case (Fri Feb 28 2003 - 20:29:29 CST)
Last message date: Fri Feb 06 2004 - 10:15:04 CST
Archived on: Thu May 05 2005 - 14:17:44 CDT
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