AMBER Archive (2005) - May 2005 By DateMost recent messages
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Starting: Sun May 01 2005 - 16:00:59 CDT
Ending: Tue May 31 2005 - 22:41:42 CDT
- AMBER: Identifying water molecules with ptraj Joseph Fernandez (Sun May 01 2005 - 16:00:59 CDT)
- AMBER: fast 1/r methods Brent Krueger (Mon May 02 2005 - 06:51:56 CDT)
- Re: AMBER: fast 1/r methods Andreas Svrcek-Seiler (Mon May 02 2005 - 09:18:22 CDT)
- Re: AMBER: fast 1/r methods fangyu liang (Mon May 02 2005 - 09:17:32 CDT)
- Re: AMBER: ipol=1 & use_pme= ?? David A. Case (Mon May 02 2005 - 11:44:47 CDT)
- AMBER: How to fix the atom in NPT case? george Chen (Mon May 02 2005 - 13:19:54 CDT)
- Re: AMBER: How to fix the atom in NPT case? David A. Case (Mon May 02 2005 - 13:31:26 CDT)
- Re: AMBER: Re: R.E.D. question Yanze Zhang (Mon May 02 2005 - 14:19:14 CDT)
- Re: AMBER: How to fix the atom in NPT case? george Chen (Mon May 02 2005 - 14:35:42 CDT)
- Re: AMBER: Re: R.E.D. question FyD (Mon May 02 2005 - 14:53:35 CDT)
- AMBER: sander run YoungJin Cho (Mon May 02 2005 - 15:45:01 CDT)
- AMBER: GB with dipoles ! Pradipta Bandyopadhyay (Tue May 03 2005 - 06:54:44 CDT)
- Fwd: Re: AMBER: AMBER Test Anthony Cruz (Tue May 03 2005 - 07:25:46 CDT)
- AMBER: Can I add iodide anione? Myunggi Yi (Tue May 03 2005 - 12:36:07 CDT)
- AMBER: rborn(i) in egb.f Harianto Tjong (Tue May 03 2005 - 14:04:39 CDT)
- Re: AMBER: rborn(i) in egb.f John Mongan (Tue May 03 2005 - 13:26:15 CDT)
- AMBER: NOE constraints Hui-Hsu Tsai (Tue May 03 2005 - 14:18:27 CDT)
- Re: AMBER: rborn(i) in egb.f Harianto Tjong (Tue May 03 2005 - 15:31:43 CDT)
- Re: AMBER: rborn(i) in egb.f David A. Case (Tue May 03 2005 - 15:23:14 CDT)
- Re: AMBER: NOE constraints David A. Case (Tue May 03 2005 - 15:25:44 CDT)
- Re: AMBER: How to fix the atom in NPT case? george Chen (Tue May 03 2005 - 15:50:59 CDT)
- Re: AMBER: rborn(i) in egb.f Harianto Tjong (Tue May 03 2005 - 17:13:16 CDT)
- Re: AMBER: rborn(i) in egb.f David A. Case (Tue May 03 2005 - 17:59:23 CDT)
- Re: AMBER: How to fix the atom in NPT case? David A. Case (Tue May 03 2005 - 19:16:33 CDT)
- AMBER: Relative stability with MMPBSA Angelo Pugliese (Wed May 04 2005 - 11:09:27 CDT)
- AMBER: Bromelain PDF xleap load error Thomas Patko (Wed May 04 2005 - 12:13:35 CDT)
- AMBER: mm/pbsa error Eric Hu (Wed May 04 2005 - 13:06:34 CDT)
- AMBER: Meaning of induced dipole moments for atom pairs? Cenk Andac (Wed May 04 2005 - 15:52:06 CDT)
- Re: AMBER: Meaning of induced dipole moments for atom pairs? David A. Case (Wed May 04 2005 - 17:13:14 CDT)
- AMBER: How can I read parm99.dat file? Myunggi Yi (Wed May 04 2005 - 18:08:49 CDT)
- Re: AMBER: How can I read parm99.dat file? Bill Ross (Wed May 04 2005 - 19:12:08 CDT)
- Re: AMBER: How can I read parm99.dat file? Vineet Pande (Thu May 05 2005 - 04:12:09 CDT)
- Re: AMBER: How can I read parm99.dat file? David A. Case (Thu May 05 2005 - 10:10:59 CDT)
- AMBER: ibelly in nmode Dawei Zhang (Thu May 05 2005 - 14:23:13 CDT)
- Re: AMBER: Bromelain PDF xleap load error (Proton Problems?) Thomas Patko (Thu May 05 2005 - 17:02:40 CDT)
- Re: AMBER: Meaning of induced dipole moments for atom pairs? Cenk Andac (Thu May 05 2005 - 19:28:49 CDT)
- Re: AMBER: Bromelain PDF xleap load error (Proton Problems?) JunJun Liu (Thu May 05 2005 - 19:37:36 CDT)
- AMBER: keeping two domains closed together during a simulation Sergio E. Wong (Thu May 05 2005 - 19:44:45 CDT)
- AMBER: problem with gb md emilia wu (Thu May 05 2005 - 21:05:00 CDT)
- RE: AMBER: problem with gb md Ross Walker (Thu May 05 2005 - 23:47:40 CDT)
- Re: RE: AMBER: problem with gb md Andreas Svrcek-Seiler (Fri May 06 2005 - 04:19:00 CDT)
- Re: AMBER: No vdW parameters for HO.. David A. Case (Fri May 06 2005 - 09:38:16 CDT)
- Re: AMBER: How can I read parm99.dat file? Myunggi Yi (Fri May 06 2005 - 09:14:04 CDT)
- Re: RE: AMBER: problem with gb md emilia wu (Fri May 06 2005 - 01:29:33 CDT)
- Re: AMBER: How can I read parm99.dat file? Myunggi Yi (Fri May 06 2005 - 09:14:15 CDT)
- Re: AMBER: How can I read parm99.dat file? Myunggi Yi (Fri May 06 2005 - 08:18:47 CDT)
- Re: AMBER: Bromelain PDF xleap load error (Proton Problems?) Andy Purkiss (Fri May 06 2005 - 06:05:36 CDT)
- AMBER: No vdW parameters for HO.. Vineet Pande (Fri May 06 2005 - 05:20:02 CDT)
- Re: AMBER: No vdW parameters for HO.. Vineet Pande (Fri May 06 2005 - 10:40:09 CDT)
- AMBER: a nomenclature question Kenley Barrett (Fri May 06 2005 - 11:11:24 CDT)
- Re: AMBER: No vdW parameters for HO.. Yong Duan (Fri May 06 2005 - 11:28:25 CDT)
- AMBER: Dr. Cornell's calculation of Sulfur vdw epsilon value in parm94.dat? Chris Moth (Fri May 06 2005 - 14:32:23 CDT)
- Re: AMBER: How can I read parm99.dat file? Bill Ross (Fri May 06 2005 - 15:08:59 CDT)
- 75% Off for All New Softs Now! haberman Rogelio Adams (Fri May 06 2005 - 22:19:57 CDT)
- Re: AMBER: ibelly in nmode David A. Case (Sat May 07 2005 - 11:44:21 CDT)
- AMBER: langevin, GB and simulated annealing - 5 pascal.baillod_at_epfl.ch (Mon May 09 2005 - 11:25:12 CDT)
- AMBER: radial distribution function Myunggi Yi (Mon May 09 2005 - 13:36:43 CDT)
- Re: AMBER: langevin, GB and simulated annealing - 5 Carlos Simmerling (Mon May 09 2005 - 14:58:57 CDT)
- Re: AMBER: langevin, GB and simulated annealing - 5 David A. Case (Mon May 09 2005 - 18:18:04 CDT)
- The new ganaration of repliccas is here capella Linda Hooks (Mon May 09 2005 - 20:53:45 CDT)
- AMBER: parameter for sulfur in thio-octyl-glucopyranoside Vijay Manickam Achari (Mon May 09 2005 - 22:23:07 CDT)
- Re: AMBER: langevin, GB and simulated annealing - 5 Carlos Simmerling (Tue May 10 2005 - 06:58:42 CDT)
- Re: AMBER: radius parameter for F atom Scott Pendley (Tue May 10 2005 - 14:49:21 CDT)
- Re: AMBER: mm/pbsa error Scott Pendley (Tue May 10 2005 - 14:56:52 CDT)
- Re: AMBER: radius parameter for F atom Scott Pendley (Tue May 10 2005 - 14:49:21 CDT)
- Re: AMBER: Bromelain PDF xleap load error (Proton Problems?) Thomas Patko (Wed May 11 2005 - 02:10:53 CDT)
- AMBER: AMBER8 Build on Linux x64 running Opterons Thomas Patko (Wed May 11 2005 - 02:10:14 CDT)
- AMBER: Trouble with example tutorial Maciej (Wed May 11 2005 - 06:08:02 CDT)
- You wont believe these pr1ces on name-brannd soft's! kerchief Ismael Childers (Wed May 11 2005 - 10:06:11 CDT)
- AMBER: Parameter for alpha-lactose Sagarika Dev (Wed May 11 2005 - 09:48:21 CDT)
- Re: AMBER: AMBER8 Build on Linux x64 running Opterons Mark Rance (Wed May 11 2005 - 10:02:05 CDT)
- Re: AMBER: AMBER8 Build on Linux x64 running Opterons Robert Duke (Wed May 11 2005 - 10:14:50 CDT)
- Re: AMBER: AMBER8 Build on Linux x64 running Opterons Robert Duke (Wed May 11 2005 - 10:18:12 CDT)
- Re: AMBER: AMBER8 Build on Linux x64 running Opterons Thomas Patko (Wed May 11 2005 - 10:34:18 CDT)
- AMBER: Asking how to creat alanine "dipeptide" in amber8 Li Su (Wed May 11 2005 - 10:37:07 CDT)
- Re: AMBER: Asking how to creat alanine "dipeptide" in amber8 Thomas E. Cheatham, III (Wed May 11 2005 - 10:38:54 CDT)
- Fwd: Re: AMBER: AMBER Test Anthony Cruz (Wed May 11 2005 - 10:49:38 CDT)
- Re: AMBER: Asking how to creat alanine "dipeptide" in amber8 FyD (Wed May 11 2005 - 11:06:27 CDT)
- AMBER: SANDER BOMB: volume of ucell too big Stern, Julie (Wed May 11 2005 - 11:07:38 CDT)
- RE: AMBER: Asking how to creat alanine "dipeptide" in amber8 Ross Walker (Wed May 11 2005 - 12:13:30 CDT)
- AMBER: Problem with xleap Ilyas Yildirim (Wed May 11 2005 - 20:45:50 CDT)
- Re: AMBER: Problem with xleap FyD (Wed May 11 2005 - 21:21:12 CDT)
- AMBER: maximum number of processors MURAT CETINKAYA (Wed May 11 2005 - 22:53:44 CDT)
- We can send you disccounted errection mads party Freeman William (Thu May 12 2005 - 00:23:35 CDT)
- Re: AMBER: Problem with xleap JunJun Liu (Thu May 12 2005 - 02:19:24 CDT)
- Re: AMBER: Parameter for alpha-lactose David A. Case (Thu May 12 2005 - 10:29:08 CDT)
- Re: Fwd: Re: AMBER: AMBER Test David A. Case (Thu May 12 2005 - 10:33:15 CDT)
- Re: AMBER: maximum number of processors Asim Okur (Thu May 12 2005 - 10:41:25 CDT)
- Re: AMBER: AMBER8 Build on Linux x64 running Opterons David A. Case (Thu May 12 2005 - 11:58:19 CDT)
- Re: AMBER: maximum number of processors Michael Crowley (Thu May 12 2005 - 12:00:09 CDT)
- Re: AMBER: Trouble with example tutorial David A. Case (Thu May 12 2005 - 12:04:51 CDT)
- AMBER: RESP charge fitting for N-methylguanine cation Grzegorz Jezierski (Thu May 12 2005 - 11:50:17 CDT)
- Re: AMBER: SANDER BOMB: volume of ucell too big Michael Crowley (Thu May 12 2005 - 12:10:20 CDT)
- RE: AMBER: SANDER BOMB: volume of ucell too big Stern, Julie (Thu May 12 2005 - 14:34:55 CDT)
- Re: AMBER: AMBER8 Build on Linux x64 running Opterons Bill Ross (Thu May 12 2005 - 15:08:34 CDT)
- Re: AMBER: SANDER BOMB: volume of ucell too big David A. Case (Thu May 12 2005 - 15:27:50 CDT)
- Re: AMBER: SANDER BOMB: volume of ucell too big Robert Duke (Thu May 12 2005 - 15:44:11 CDT)
- AMBER: Tutorial #1 ptraj/sander problem Daniela Kohen (Thu May 12 2005 - 17:03:07 CDT)
- RE: AMBER: parameter for sulfur in thio-octyl-glucopyranoside Spero Manolatos (Thu May 12 2005 - 17:08:49 CDT)
- Re: AMBER: a nomenclature question David A. Case (Thu May 12 2005 - 17:18:20 CDT)
- RE: AMBER: Tutorial #1 ptraj/sander problem Ross Walker (Thu May 12 2005 - 17:33:44 CDT)
- Re: AMBER: Problem with xleap Ilyas Yildirim (Thu May 12 2005 - 18:14:38 CDT)
- AMBER: the restraint MD fail with amber8,but success with amber7 Shulin Zhuang (Thu May 12 2005 - 20:44:04 CDT)
- Re: AMBER: RESP charge fitting for N-methylguanine cation Kara Di Giorgio (Thu May 12 2005 - 21:40:17 CDT)
- AMBER: amber8 test error Cordova, Luis E. (Thu May 12 2005 - 22:26:00 CDT)
- Re: AMBER: the restraint MD fail with amber8,but success with amber7 Carlos Simmerling (Fri May 13 2005 - 05:50:10 CDT)
- AMBER: creating residues - charge assign problems Hayden Eastwood (Fri May 13 2005 - 06:06:06 CDT)
- Re: AMBER: the restraint MD fail with amber8,but success with amber7 Shulin Zhuang (Fri May 13 2005 - 06:19:20 CDT)
- Re: AMBER: the restraint MD fail with amber8,but success with amber7 Shulin Zhuang (Fri May 13 2005 - 06:21:28 CDT)
- Re: AMBER: creating residues - charge assign problems FyD (Fri May 13 2005 - 10:25:48 CDT)
- Re: AMBER: RESP charge fitting for N-methylguanine cation FyD (Fri May 13 2005 - 10:33:05 CDT)
- Re: AMBER: creating residues - charge assign problems David A. Case (Fri May 13 2005 - 11:43:41 CDT)
- Re: AMBER: amber8 test error David A. Case (Fri May 13 2005 - 12:11:27 CDT)
- AMBER: platinum atom in Xleap Chen Chengwen (Fri May 13 2005 - 21:11:12 CDT)
- Re: AMBER: maximum number of processors Abd Ghani Abd Aziz (Sat May 14 2005 - 01:42:49 CDT)
- AMBER: How to create a parallel job for amber 8? Ò׺ç (Sat May 14 2005 - 06:20:15 CDT)
- Re: AMBER: How to create a parallel job for amber 8? Shulin Zhuang (Sat May 14 2005 - 08:45:54 CDT)
- A new rollax repliccas is in the mark. attitudinal Russel Granger (Sat May 14 2005 - 11:02:36 CDT)
- Re: AMBER: maximum number of processors C J Kenneth Tan -- OptimaNumerics (Sat May 14 2005 - 09:57:22 CDT)
- AMBER: Which source file determine the initial value of IX XX arrray in AMBER8? caoch_at_cherry.bio.titech.ac.jp (Sat May 14 2005 - 12:17:17 CDT)
- Re: AMBER: Which source file determine the initial value of IX XX arrray in AMBER8? Carlos Simmerling (Sat May 14 2005 - 12:52:56 CDT)
- AMBER: Calculating of radius of gyration in Carnal Hwankyu Lee (Sat May 14 2005 - 13:36:37 CDT)
- RE: AMBER: Which source file determine the initial value of IX XX arrray in AMBER8? ross_at_rosswalker.co.uk (Sat May 14 2005 - 14:43:46 CDT)
- Re: AMBER: Calculating of radius of gyration in Carnal Bill Ross (Sat May 14 2005 - 17:26:43 CDT)
- AMBER: how to reduce box size and delete excess solvent hj zou (Sun May 15 2005 - 06:51:32 CDT)
- AMBER: How to set constraint Li Su (Sun May 15 2005 - 13:58:51 CDT)
- Re: AMBER: how to reduce box size and delete excess solvent Bill Ross (Sun May 15 2005 - 14:50:01 CDT)
- AMBER: generating over 16 bps of DNA in nucgen Hwankyu Lee (Mon May 16 2005 - 10:33:04 CDT)
- AMBER: strange mm_pbsa.pl bug Nelson Fonseca (Mon May 16 2005 - 10:39:21 CDT)
- Re: AMBER: How to set constraint David A. Case (Mon May 16 2005 - 10:42:27 CDT)
- AMBER: How to set up dihedral constraints in amber Li Su (Mon May 16 2005 - 10:39:50 CDT)
- AMBER: output of force field info Stern, Julie (Mon May 16 2005 - 14:24:37 CDT)
- AMBER: nmode in mmpbsa Joseph Fernandez (Mon May 16 2005 - 18:36:28 CDT)
- Re: AMBER: output of force field info David A. Case (Mon May 16 2005 - 19:16:55 CDT)
- AMBER: *** Proper torsion parameters missing *** Ilyas Yildirim (Mon May 16 2005 - 19:19:04 CDT)
- Re: AMBER: output of force field info Thomas E. Cheatham, III (Mon May 16 2005 - 20:21:51 CDT)
- AMBER: ATOM TYPE Ilyas Yildirim (Mon May 16 2005 - 21:10:48 CDT)
- Re: AMBER: nmode in mmpbsa Holger Gohlke (Tue May 17 2005 - 01:44:17 CDT)
- AMBER: MMPBSA calculations on Highly charged systems Vitor Manuel Sousa F?x (Tue May 17 2005 - 06:01:21 CDT)
- Re: AMBER: MMPBSA calculations on Highly charged systems Nelson Fonseca (Tue May 17 2005 - 07:36:16 CDT)
- Re: AMBER: generating over 16 bps of DNA in nucgen Garhan Attebury (Tue May 17 2005 - 10:27:13 CDT)
- AMBER: Message in .out file Atilio Anzellotti (Tue May 17 2005 - 07:31:36 CDT)
- Re: AMBER: generating over 16 bps of DNA in nucgen aanzellotti_at_mail2.vcu.edu (Tue May 17 2005 - 10:57:45 CDT)
- AMBER: GAFF angle parameters Monica Civera (Tue May 17 2005 - 11:11:46 CDT)
- AMBER: molsurf error mingche Pan (Tue May 17 2005 - 11:52:57 CDT)
- AMBER: compiling pmemd on dual xeon Tiziano Tuccinardi (Tue May 17 2005 - 12:28:31 CDT)
- Re: AMBER: compiling pmemd on dual xeon Robert Duke (Tue May 17 2005 - 12:49:48 CDT)
- Re: AMBER: compiling pmemd on dual xeon Tiziano Tuccinardi (Tue May 17 2005 - 13:05:49 CDT)
- AMBER: ERROR in readParm: ...failed to find ANGLES_INC_HYDROGEN Rajeev Ranjan Singh (Tue May 17 2005 - 15:15:33 CDT)
- AMBER: gaff: ca-ca-c -o torsion parameter Oliver Hucke (Tue May 17 2005 - 15:54:24 CDT)
- AMBER: amber 8 REM possible test problem Sergio E. Wong (Tue May 17 2005 - 16:51:04 CDT)
- RE: AMBER: GAFF angle parameters Junmei Wang (Tue May 17 2005 - 17:08:47 CDT)
- FW: Office XP - 60 dolars! coagulate Myra Cole (Tue May 17 2005 - 19:04:52 CDT)
- AMBER: RE: Tutorial#1 ptraj/sander problem Ross Walker (Tue May 17 2005 - 17:56:59 CDT)
- AMBER: MD on surface Yanze Zhang (Tue May 17 2005 - 18:58:29 CDT)
- AMBER: error with ptraj Xiaowei (David) Li (Tue May 17 2005 - 23:27:33 CDT)
- AMBER: loading pdb cbala_at_igib.res.in (Wed May 18 2005 - 00:56:13 CDT)
- Re: AMBER: loading pdb David A. Case (Wed May 18 2005 - 01:38:27 CDT)
- Re: AMBER: error with ptraj David A. Case (Wed May 18 2005 - 01:38:22 CDT)
- Re: AMBER: gaff: ca-ca-c -o torsion parameter David A. Case (Wed May 18 2005 - 01:38:33 CDT)
- Re: AMBER: Message in .out file David A. Case (Wed May 18 2005 - 01:38:40 CDT)
- AMBER: Using AMBER for Carbon nanotubes Zhang Yingyan (Wed May 18 2005 - 03:21:42 CDT)
- Re: AMBER: loading pdb Rajeev Ranjan Singh (Wed May 18 2005 - 09:01:34 CDT)
- RE: AMBER: Using AMBER for Carbon nanotubes Ross Walker (Wed May 18 2005 - 12:12:29 CDT)
- AMBER: error during MD run cbala_at_igib.res.in (Wed May 18 2005 - 13:39:25 CDT)
- Re: AMBER: error during MD run Thomas E. Cheatham, III (Wed May 18 2005 - 13:10:36 CDT)
- Re: AMBER: error during MD run Rajeev Ranjan Singh (Wed May 18 2005 - 13:16:12 CDT)
- AMBER: frcmod info for Nickel Kara Di Giorgio (Wed May 18 2005 - 14:04:44 CDT)
- Re: AMBER: loading pdb Ilyas Yildirim (Wed May 18 2005 - 15:21:24 CDT)
- AMBER: parameter for sulfur in thio-glucoside residue Vijay Manickam Achari (Wed May 18 2005 - 20:58:57 CDT)
- Re: AMBER: parameter for sulfur in thio-glucoside residue Ilyas Yildirim (Wed May 18 2005 - 21:11:34 CDT)
- AMBER: Can we load prmtop and inpcrd files into xleap? Ilyas Yildirim (Wed May 18 2005 - 21:16:35 CDT)
- Re: AMBER: Can we load prmtop and inpcrd files into xleap? Kara Di Giorgio (Wed May 18 2005 - 21:45:43 CDT)
- Re: AMBER: Can we load prmtop and inpcrd files into xleap? Ilyas Yildirim (Wed May 18 2005 - 23:00:07 CDT)
- Re: AMBER: Can we load prmtop and inpcrd files into xleap? Kara Di Giorgio (Wed May 18 2005 - 23:10:36 CDT)
- Re: AMBER: Can we load prmtop and inpcrd files into xleap? Ilyas Yildirim (Wed May 18 2005 - 23:47:49 CDT)
- Re: AMBER: Can we load prmtop and inpcrd files into xleap? Bill Ross (Wed May 18 2005 - 23:49:04 CDT)
- AMBER: Amber 8 and LAM compilation problem Glen Otero (Thu May 19 2005 - 00:52:00 CDT)
- AMBER: the out put I get... parameter for sulfur in thio-glucoside residue Vijay Manickam Achari (Thu May 19 2005 - 01:55:21 CDT)
- RE: AMBER: the out put I get... parameter for sulfur in thio-glucoside residue Ross Walker (Thu May 19 2005 - 02:16:41 CDT)
- Re: AMBER: the out put I get... parameter for sulfur in thio-glucoside residue Ilyas Yildirim (Thu May 19 2005 - 02:37:22 CDT)
- AMBER: GB - igb=1 versus dielc=? milion_at_c-box.cz (Thu May 19 2005 - 03:36:34 CDT)
- Re: AMBER: Amber 8 and LAM compilation problem Robert Duke (Thu May 19 2005 - 07:05:48 CDT)
- AMBER: write format of restart crd in sander/pmemd Peter Varnai (Thu May 19 2005 - 07:12:22 CDT)
- AMBER: Using amber4 generated prep files in amber8? Simon Whitehead (Thu May 19 2005 - 07:51:00 CDT)
- Re: AMBER: Using amber4 generated prep files in amber8? David A. Case (Thu May 19 2005 - 10:31:54 CDT)
- Re: AMBER: GB - igb=1 versus dielc=? David A. Case (Thu May 19 2005 - 11:09:47 CDT)
- Re: AMBER: the out put I get... parameter for sulfur in thio-glucoside residue Cenk Andac (Thu May 19 2005 - 12:03:43 CDT)
- AMBER: read pdb back to xleap after solvation of chloroform chaiann ng (Thu May 19 2005 - 20:19:04 CDT)
- Re: AMBER: read pdb back to xleap after solvation of chloroform David A. Case (Thu May 19 2005 - 20:38:49 CDT)
- RE: AMBER: read pdb back to xleap after solvation of chloroform Ross Walker (Thu May 19 2005 - 20:41:31 CDT)
- Re: AMBER: read pdb back to xleap after solvation of chloroform chaiann ng (Thu May 19 2005 - 20:59:47 CDT)
- RE: AMBER: read pdb back to xleap after solvation of chloroform chaiann ng (Thu May 19 2005 - 21:05:27 CDT)
- RE: AMBER: read pdb back to xleap after solvation of chloroform Bill Ross (Thu May 19 2005 - 21:16:22 CDT)
- RE: AMBER: read pdb back to xleap after solvation of chloroform chaiann ng (Thu May 19 2005 - 21:55:23 CDT)
- RE: AMBER: read pdb back to xleap after solvation of chloroform Bill Ross (Thu May 19 2005 - 22:56:58 CDT)
- AMBER: MM_PBSA for NMR restrained structures Cenk Andac (Fri May 20 2005 - 03:36:10 CDT)
- AMBER: leap problem: savepdb Hannes Barsch (Fri May 20 2005 - 04:30:29 CDT)
- AMBER: Re: antechamber not working .. for thio residue.. Vijay Manickam Achari (Fri May 20 2005 - 04:32:19 CDT)
- AMBER: how to creat leaprc.gaff Vijay Manickam Achari (Fri May 20 2005 - 04:36:25 CDT)
- Re: AMBER: how to creat leaprc.gaff Ilyas Yildirim (Fri May 20 2005 - 04:48:14 CDT)
- Re: AMBER: Re: antechamber not working .. for thio residue.. Shulin Zhuang (Fri May 20 2005 - 05:22:39 CDT)
- AMBER: Error in minimization Priti Hansia (Fri May 20 2005 - 05:58:36 CDT)
- Re: AMBER: Error in minimization Carlos Simmerling (Fri May 20 2005 - 07:57:37 CDT)
- Re: AMBER: Representation of cations in MD David A. Case (Fri May 20 2005 - 10:16:15 CDT)
- Re: AMBER: leap problem: savepdb David A. Case (Fri May 20 2005 - 10:21:13 CDT)
- AMBER: Steve Seibold (Fri May 20 2005 - 12:45:24 CDT)
- Re: AMBER: luckyang_at_gmail.com (Fri May 20 2005 - 13:28:17 CDT)
- AMBER: crashing xleap Kenley Barrett (Fri May 20 2005 - 13:48:13 CDT)
- AMBER: 1-4 scaling factors Stern, Julie (Fri May 20 2005 - 14:13:22 CDT)
- Re: AMBER: 1-4 scaling factors Thomas E. Cheatham, III (Fri May 20 2005 - 14:43:34 CDT)
- Re: AMBER: crashing xleap Bill Ross (Fri May 20 2005 - 14:55:15 CDT)
- Re: AMBER: crashing xleap Scott Brozell (Fri May 20 2005 - 15:03:40 CDT)
- Re: AMBER: crashing xleap Kenley Barrett (Fri May 20 2005 - 15:57:00 CDT)
- Re: AMBER: read pdb back to xleap after solvation of chloroform Furse, Kristina Elisabet (Fri May 20 2005 - 16:20:55 CDT)
- AMBER: Citing the PBSA module of AMBER8 Cenk Andac (Fri May 20 2005 - 16:27:03 CDT)
- Re: AMBER: crashing xleap Ilyas Yildirim (Fri May 20 2005 - 16:47:09 CDT)
- Re: AMBER: crashing xleap Furse, Kristina Elisabet (Fri May 20 2005 - 17:28:05 CDT)
- Re: AMBER: JunJun Liu (Fri May 20 2005 - 21:41:24 CDT)
- AMBER: modeller Zhang Bing (Fri May 20 2005 - 23:53:13 CDT)
- AMBER: rotating and repositioning molecules in xleap Hwankyu Lee (Sat May 21 2005 - 01:09:45 CDT)
- AMBER: Copyright for PBSA Cenk Andac (Sat May 21 2005 - 03:32:00 CDT)
- Re: AMBER: Copyright for PBSA David A. Case (Sat May 21 2005 - 22:37:45 CDT)
- Re: AMBER: rotating and repositioning molecules in xleap Angelo Pugliese (Sun May 22 2005 - 04:37:44 CDT)
- Re: AMBER: rotating and repositioning molecules in xleap Hwankyu Lee (Sun May 22 2005 - 08:03:40 CDT)
- Re: AMBER: rotating and repositioning molecules in xleap Bill Ross (Sun May 22 2005 - 10:36:16 CDT)
- AMBER: Unexpected stop of Sander run Grzegorz Jezierski (Sun May 22 2005 - 14:44:55 CDT)
- Re: AMBER: Unexpected stop of Sander run Bill Ross (Sun May 22 2005 - 15:18:16 CDT)
- Re: AMBER: Unexpected stop of Sander run Carlos Simmerling (Sun May 22 2005 - 15:22:11 CDT)
- AMBER: Error in sander: stack trace terminated abnormally. Hwankyu Lee (Sun May 22 2005 - 16:05:31 CDT)
- RE: AMBER: Error in sander: stack trace terminated abnormally. Ross Walker (Sun May 22 2005 - 16:53:36 CDT)
- AMBER: antechamber not working .. for thio residue.. Vijay Manickam Achari (Sun May 22 2005 - 21:15:20 CDT)
- Re: AMBER: antechamber not working .. for thio residue.. Shulin Zhuang (Sun May 22 2005 - 21:31:27 CDT)
- Re: AMBER: Unexpected stop of Sander run Grzegorz Jezierski (Mon May 23 2005 - 02:14:54 CDT)
- AMBER: Setting Amber force field parameters Chen Chengwen (Mon May 23 2005 - 02:55:38 CDT)
- AMBER: using antechamber ... to get prepin file Vijay Manickam Achari (Mon May 23 2005 - 03:59:16 CDT)
- Re: AMBER: Unexpected stop of Sander run Carlos Simmerling (Mon May 23 2005 - 06:15:34 CDT)
- RE: AMBER: using antechamber ... to get prepin file Vineet Pande (Mon May 23 2005 - 07:02:26 CDT)
- Re: AMBER: Unexpected stop of Sander run Grzegorz Jezierski (Mon May 23 2005 - 08:43:51 CDT)
- Re: AMBER: Unexpected stop of Sander run Carlos Simmerling (Mon May 23 2005 - 08:57:00 CDT)
- Re: AMBER: Unexpected stop of Sander run Grzegorz Jezierski (Mon May 23 2005 - 09:38:58 CDT)
- Re: AMBER: Unexpected stop of Sander run David A. Case (Mon May 23 2005 - 10:00:46 CDT)
- AMBER: Connecting two molecules Hwankyu Lee (Mon May 23 2005 - 10:13:00 CDT)
- Re: AMBER: Connecting two molecules David A. Case (Mon May 23 2005 - 10:23:51 CDT)
- Re: AMBER: Connecting two molecules Hwankyu Lee (Mon May 23 2005 - 11:51:20 CDT)
- Re: AMBER: crashing xleap; bugfix.44 Scott Brozell (Mon May 23 2005 - 12:22:51 CDT)
- AMBER: hbond detailed analysis over time? pascal.baillod_at_epfl.ch (Mon May 23 2005 - 13:04:10 CDT)
- AMBER: how to generate frcmod file for using prepin file.. Vijay Manickam Achari (Mon May 23 2005 - 21:52:18 CDT)
- RE: AMBER: how to generate frcmod file for using prepin file.. chaiann ng (Mon May 23 2005 - 22:03:55 CDT)
- AMBER: my frcmod file created using parmchk Vijay Manickam Achari (Mon May 23 2005 - 22:44:21 CDT)
- Re: AMBER: my frcmod file created using parmchk Ilyas Yildirim (Mon May 23 2005 - 23:03:42 CDT)
- AMBER: my prepin file in lowe-case Vijay Manickam Achari (Tue May 24 2005 - 02:51:55 CDT)
- AMBER: Which forcefield? Simon Whitehead (Tue May 24 2005 - 03:13:01 CDT)
- AMBER: conformational sampling of a peptide Hannes Barsch (Tue May 24 2005 - 03:58:04 CDT)
- AMBER: amber code Juan Fernandez Carmona (Tue May 24 2005 - 05:08:00 CDT)
- Re: AMBER: conformational sampling of a peptide Carlos Simmerling (Tue May 24 2005 - 08:11:53 CDT)
- Re: AMBER: amber code Andreas Svrcek-Seiler (Tue May 24 2005 - 09:18:11 CDT)
- AMBER: Fw: Installing PMEMD on IBM machine (CPU power4) running SUSE_9.1 Robert Duke (Tue May 24 2005 - 09:42:15 CDT)
- Re: AMBER: conformational sampling of a peptide Joseph Nachman (Tue May 24 2005 - 10:26:52 CDT)
- AMBER: Amber 8 : installation problems : undefined reference to `mpi_allreduce_' René Ranzinger (Tue May 24 2005 - 10:04:42 CDT)
- AMBER: Sander Restart Problem Garhan Attebury (Tue May 24 2005 - 10:07:49 CDT)
- AMBER: How to fix certain bond angles Li Su (Tue May 24 2005 - 10:27:14 CDT)
- Re: AMBER: How to fix certain bond angles Guanglei Cui (Tue May 24 2005 - 10:40:00 CDT)
- RE: AMBER: Amber 8 : installation problems : undefined reference to `mpi_allreduce_' Ross Walker (Tue May 24 2005 - 10:43:37 CDT)
- AMBER: Error: vlimit exceeded for step Hwankyu Lee (Tue May 24 2005 - 12:20:10 CDT)
- Re: AMBER: Error: vlimit exceeded for step Carlos Simmerling (Tue May 24 2005 - 12:51:14 CDT)
- Re: AMBER: Error: vlimit exceeded for step Hwankyu Lee (Tue May 24 2005 - 13:07:41 CDT)
- Re: AMBER: Error: vlimit exceeded for step Thomas E. Cheatham, III (Tue May 24 2005 - 13:12:58 CDT)
- Re: AMBER: Error: vlimit exceeded for step Hwankyu Lee (Tue May 24 2005 - 13:34:34 CDT)
- Solute-solvent boundary in pbsa ..Re: AMBER: Copyright for PBSA Cenk Andac (Tue May 24 2005 - 13:48:26 CDT)
- AMBER: Is Amber able to constrain(not restrain) certain angles at certain values? Li Su (Tue May 24 2005 - 14:14:09 CDT)
- Re: AMBER: Error: vlimit exceeded for step David Mobley (Tue May 24 2005 - 14:27:23 CDT)
- Re: AMBER: Solute-solvent boundary in pbsa Ray Luo (Tue May 24 2005 - 03:48:10 CDT)
- AMBER: charges difference of atom in xleap and prmtop chaiann ng (Tue May 24 2005 - 23:02:33 CDT)
- Re: AMBER: charges difference of atom in xleap and prmtop David A. Case (Wed May 25 2005 - 00:27:51 CDT)
- Re: AMBER: Which forcefield? David A. Case (Wed May 25 2005 - 00:32:09 CDT)
- AMBER: PARMSCAN program Philippe ARNAUD (Wed May 25 2005 - 02:28:31 CDT)
- AMBER: average structure after MD kuljeets_at_igib.res.in (Wed May 25 2005 - 04:14:19 CDT)
- AMBER: quadrupole in resp riccardo nifosi (Wed May 25 2005 - 05:44:20 CDT)
- Re: AMBER: Is Amber able to constrain(not restrain) certain angles at certain values? Petr Kulhanek (Wed May 25 2005 - 06:56:34 CDT)
- Re: AMBER: Is Amber able to constrain(not restrain) certain angles at certain values? Guanglei Cui (Wed May 25 2005 - 08:55:23 CDT)
- AMBER: error in chirality.c? Kenley Barrett (Wed May 25 2005 - 09:27:07 CDT)
- Re: AMBER: error in chirality.c? David A. Case (Wed May 25 2005 - 10:21:48 CDT)
- Re: AMBER: Solute-solvent boundary in pbsa Cenk Andac (Wed May 25 2005 - 11:21:52 CDT)
- Re#2:Re: AMBER: Solute-solvent boundary in pbsa Cenk Andac (Wed May 25 2005 - 15:03:47 CDT)
- Re: Re#2:Re: AMBER: Solute-solvent boundary in pbsa Ray Luo (Wed May 25 2005 - 00:56:08 CDT)
- Re: AMBER: Solute-solvent boundary in pbsa Ray Luo (Wed May 25 2005 - 00:54:50 CDT)
- AMBER: antechamber, reference? Cenk Andac (Wed May 25 2005 - 16:14:48 CDT)
- Re: AMBER: antechamber, reference? David A. Case (Wed May 25 2005 - 16:36:19 CDT)
- AMBER: dissolving micelle structure in water.. amber7 Vijay Manickam Achari (Wed May 25 2005 - 22:59:22 CDT)
- Re: AMBER: average structure after MD kuljeets_at_igib.res.in (Thu May 26 2005 - 00:42:32 CDT)
- AMBER: distance restraints between two centers of mass JAVIER PEREZ (Thu May 26 2005 - 03:37:30 CDT)
- Re: AMBER: distance restraints between two centers of mass Fabien Cailliez (Thu May 26 2005 - 04:01:08 CDT)
- Re: AMBER: Is Amber able to constrain(not restrain) certain angles at certain values? Petr Kulhanek (Thu May 26 2005 - 05:44:37 CDT)
- AMBER: Is the MD simulation normal Shulin Zhuang (Thu May 26 2005 - 10:30:48 CDT)
- AMBER: setting up Parallel processing mathew k varghese (Thu May 26 2005 - 10:39:00 CDT)
- Re: AMBER: setting up Parallel processing Robert Duke (Thu May 26 2005 - 11:15:30 CDT)
- AMBER: hbond analysis in ptaj/carnal Jana Precechtelova (Thu May 26 2005 - 11:25:20 CDT)
- Re: AMBER: dissolving micelle structure in water.. amber7 David A. Case (Thu May 26 2005 - 11:30:17 CDT)
- Re: AMBER: hbond analysis in ptaj/carnal Bill Ross (Thu May 26 2005 - 11:44:13 CDT)
- Re: AMBER: dissolving micelle structure in water.. amber7 Bill Ross (Thu May 26 2005 - 11:50:23 CDT)
- RE: AMBER: Is the MD simulation normal Yong Duan (Thu May 26 2005 - 12:05:14 CDT)
- Re: AMBER: hbond analysis in ptaj/carnal Thomas E. Cheatham, III (Thu May 26 2005 - 12:05:00 CDT)
- AMBER: why is snaupe.f is empty? Cordova, Luis E. (Thu May 26 2005 - 12:06:24 CDT)
- Re: AMBER: Is the MD simulation normal Thomas E. Cheatham, III (Thu May 26 2005 - 12:41:03 CDT)
- AMBER: ptraj - hbond detailed analysis over time? pascal.baillod_at_epfl.ch (Thu May 26 2005 - 12:38:38 CDT)
- RE: AMBER: why is snaupe.f is empty? 'Ross Walker' (Thu May 26 2005 - 13:14:34 CDT)
- RE: AMBER: setting up Parallel processing 'Ross Walker' (Thu May 26 2005 - 13:14:18 CDT)
- Re:Re: AMBER: Solute-solvent boundary in pbsa Cenk Andac (Thu May 26 2005 - 15:58:55 CDT)
- Re: AMBER: Solute-solvent boundary in pbsa Ray Luo (Wed May 25 2005 - 20:40:39 CDT)
- AMBER: Mol2 to prepin file conversion Andrew Box (Thu May 26 2005 - 19:08:22 CDT)
- Re: AMBER: Mol2 to prepin file conversion David A. Case (Thu May 26 2005 - 19:44:36 CDT)
- Re: AMBER: dissolving micelle structure in water.. amber7 Vijay Manickam Achari (Thu May 26 2005 - 20:19:57 CDT)
- Re: AMBER: Is the MD simulation normal Shulin Zhuang (Thu May 26 2005 - 23:23:37 CDT)
- RE: AMBER: Is the MD simulation normal Yong Duan (Fri May 27 2005 - 01:17:00 CDT)
- Re: AMBER: Is the MD simulation normal Shulin Zhuang (Fri May 27 2005 - 02:38:05 CDT)
- RE: AMBER: Is the MD simulation normal Yong Duan (Fri May 27 2005 - 11:31:27 CDT)
- Re: AMBER: Is the MD simulation normal Bill Ross (Fri May 27 2005 - 13:14:30 CDT)
- AMBER: question about loadiing pdb file of a molecule complex gtg549i_at_mail.gatech.edu (Fri May 27 2005 - 16:39:28 CDT)
- AMBER: Workshop Tutorials Downtime this weekend. Ross Walker (Fri May 27 2005 - 16:49:05 CDT)
- Re: AMBER: question about loadiing pdb file of a molecule complex Chutintorn Punwong (Fri May 27 2005 - 17:07:52 CDT)
- Re: AMBER: Is the MD simulation normal Shulin Zhuang (Sat May 28 2005 - 08:02:05 CDT)
- Re: AMBER: Is the MD simulation normal Bill Ross (Sat May 28 2005 - 12:00:42 CDT)
- Re: AMBER: question about loadiing pdb file of a molecule complex David A. Case (Sun May 29 2005 - 00:29:53 CDT)
- Re: AMBER: Is the MD simulation normal Shulin Zhuang (Sun May 29 2005 - 09:53:35 CDT)
- Re: AMBER: Is the MD simulation normal Bill Ross (Sun May 29 2005 - 10:33:13 CDT)
- RE: AMBER: Is the MD simulation normal Yong Duan (Sun May 29 2005 - 11:46:44 CDT)
- RE: AMBER: Is the MD simulation normal Bill Ross (Sun May 29 2005 - 12:04:01 CDT)
- AMBER: Antechamber RESP failed for large organic molecule junwang (Sun May 29 2005 - 14:57:59 CDT)
- AMBER: question about initial conditions for amber Ed Pate (Sun May 29 2005 - 21:42:21 CDT)
- AMBER: density profiles in ptraj or carnal Hwankyu Lee (Sun May 29 2005 - 22:27:37 CDT)
- AMBER: pairwise energy decomposition using MM-PBSA Xin Hu (Sun May 29 2005 - 22:38:30 CDT)
- AMBER: Reference (?) for normal-mode analysis in nmode Cenk Andac (Mon May 30 2005 - 04:18:59 CDT)
- Re: AMBER: question about initial conditions for amber Stefano Federico Pieraccini (Mon May 30 2005 - 06:44:54 CDT)
- Re: AMBER: question about initial conditions for amber Stefano Federico Massimiliano Pieraccini (Stefano.Pieraccini) (Mon May 30 2005 - 06:40:59 CDT)
- AMBER: Force field modification problem yuann (Mon May 30 2005 - 06:16:27 CDT)
- Re: AMBER: Is the MD simulation normal Shulin Zhuang (Mon May 30 2005 - 09:39:50 CDT)
- Re: AMBER: question about loadiing pdb file of a molecule complex gtg549i_at_mail.gatech.edu (Mon May 30 2005 - 10:56:09 CDT)
- AMBER: Bond angle restraints setting files Li Su (Mon May 30 2005 - 11:05:15 CDT)
- Re: AMBER: Antechamber RESP failed for large organic molecule David A. Case (Mon May 30 2005 - 11:09:27 CDT)
- Re: AMBER: Force field modification problem David A. Case (Mon May 30 2005 - 11:21:00 CDT)
- Re: AMBER: Is the MD simulation normal Bill Ross (Mon May 30 2005 - 11:49:32 CDT)
- Re: AMBER: density profiles in ptraj or carnal Bill Ross (Mon May 30 2005 - 12:00:08 CDT)
- Re: AMBER: density profiles in ptraj or carnal Hwankyu Lee (Mon May 30 2005 - 17:58:54 CDT)
- Re[2]: AMBER: Force field modification problem sychen (Mon May 30 2005 - 19:05:45 CDT)
- Re: AMBER: density profiles in ptraj or carnal Hwankyu Lee (Mon May 30 2005 - 23:13:26 CDT)
- Re: AMBER: Force field modification problem David A. Case (Tue May 31 2005 - 00:17:06 CDT)
- AMBER: density problem cristian obiol (Tue May 31 2005 - 04:17:46 CDT)
- AMBER: stack terminated abnormally drugdesign (Tue May 31 2005 - 05:20:33 CDT)
- RE: AMBER: Antechamber RESP failed for large organic molecule Junmei Wang (Tue May 31 2005 - 09:37:35 CDT)
- AMBER: if setting ntf=4, will it cause someproblem? Li Su (Tue May 31 2005 - 09:55:03 CDT)
- Re: AMBER: if setting ntf=4, will it cause someproblem? Carlos Simmerling (Tue May 31 2005 - 10:12:30 CDT)
- AMBER: Error on restrained MD equilibration (AMBER 7) L Jin (Tue May 31 2005 - 10:23:51 CDT)
- Re: AMBER: Reference (?) for normal-mode analysis in nmode David A. Case (Tue May 31 2005 - 10:30:10 CDT)
- RE: AMBER: density problem Ross Walker (Tue May 31 2005 - 10:33:39 CDT)
- RE: AMBER: stack terminated abnormally Ross Walker (Tue May 31 2005 - 10:35:15 CDT)
- AMBER: DNA base-flipping: TI vs PMF Lauren O'Neil (Tue May 31 2005 - 10:40:45 CDT)
- Re: AMBER: Error on restrained MD equilibration (AMBER 7) David A. Case (Tue May 31 2005 - 10:45:01 CDT)
- Re: AMBER: Error on restrained MD equilibration (AMBER 7) Viktor Hornak (Tue May 31 2005 - 10:52:48 CDT)
- Re: RE: AMBER: Antechamber RESP failed for large organic molecule junwang (Tue May 31 2005 - 11:58:33 CDT)
- AMBER: Failure of Periodic Boundary Conditions using LEAP in AMBER8 with "OldPrmtopFormat on" Grzegorz Jezierski (Tue May 31 2005 - 11:04:20 CDT)
- Re: AMBER: density profiles in ptraj or carnal Bill Ross (Tue May 31 2005 - 11:13:28 CDT)
- RE: AMBER: Failure of Periodic Boundary Conditions using LEAP in AMBER8 with "OldPrmtopFormat on" Ross Walker (Tue May 31 2005 - 11:09:20 CDT)
- Re: AMBER: Failure of Periodic Boundary Conditions using LEAP in AMBER8 with "OldPrmtopFormat on" Marcin Krol (Tue May 31 2005 - 11:17:30 CDT)
- Re: AMBER: Error on restrained MD equilibration (AMBER 7) L Jin (Tue May 31 2005 - 11:21:55 CDT)
- AMBER: MM-PBSA calculation masi_at_nmr.mpibpc.mpg.de (Tue May 31 2005 - 11:37:40 CDT)
- AMBER: STOP 0 masi_at_nmr.mpibpc.mpg.de (Tue May 31 2005 - 11:40:25 CDT)
- RE: AMBER: Error on restrained MD equilibration (AMBER 7) Ross Walker (Tue May 31 2005 - 11:45:19 CDT)
- RE: AMBER: STOP 0 Ross Walker (Tue May 31 2005 - 11:47:20 CDT)
- AMBER: runtime error in sander? Dave S Walker (Tue May 31 2005 - 12:07:13 CDT)
- AMBER:Sander errors: Unit 6 Error on OPEN: mdout Douali, Latifa (Tue May 31 2005 - 12:34:41 CDT)
- RE: AMBER: runtime error in sander? Ross Walker (Tue May 31 2005 - 12:34:51 CDT)
- Re: AMBER: STOP 0 Bill Ross (Tue May 31 2005 - 12:43:32 CDT)
- RE: AMBER:Sander errors: Unit 6 Error on OPEN: mdout Ross Walker (Tue May 31 2005 - 12:45:53 CDT)
- AMBER: Loading pdb-residue (re)numbering in leap gtg549i_at_mail.gatech.edu (Tue May 31 2005 - 12:48:13 CDT)
- Re: AMBER: question about loadiing pdb file of a molecule complex David A. Case (Tue May 31 2005 - 13:00:59 CDT)
- RE: AMBER:Sander errors: Unit 6 Error on OPEN: mdout Bill Ross (Tue May 31 2005 - 13:42:50 CDT)
- Re: AMBER: Error on restrained MD equilibration (AMBER 7) Guanglei Cui (Tue May 31 2005 - 14:02:46 CDT)
- Re: AMBER: question about loadiing pdb file of a molecule complex gtg549i_at_mail.gatech.edu (Tue May 31 2005 - 14:12:39 CDT)
- AMBER: meaningful tax for sander question Cordova, Luis E. (Tue May 31 2005 - 14:19:30 CDT)
- Re: AMBER: meaningful tax for sander question David A. Case (Tue May 31 2005 - 14:59:20 CDT)
- RE: AMBER: meaningful tax for sander question Ross Walker (Tue May 31 2005 - 14:55:14 CDT)
- RE: AMBER: meaningful tax for sander question Cordova, Luis E. (Tue May 31 2005 - 15:03:59 CDT)
- RE: AMBER: meaningful tax for sander question Ross Walker (Tue May 31 2005 - 15:12:10 CDT)
- Re: AMBER: if setting ntf=4, will it cause someproblem? Li Su (Tue May 31 2005 - 16:07:25 CDT)
- AMBER: double counting of potentials Stern, Julie (Tue May 31 2005 - 18:04:43 CDT)
- RE: AMBER: double counting of potentials Ross Walker (Tue May 31 2005 - 18:21:43 CDT)
- AMBER: Working with a nickel-organometallic compound Kara Di Giorgio (Tue May 31 2005 - 18:36:30 CDT)
- AMBER: External Field in AMBER? junwang (Tue May 31 2005 - 21:19:38 CDT)
- Re: AMBER: Error on restrained MD equilibration (AMBER 7) Shulin Zhuang (Tue May 31 2005 - 20:36:32 CDT)
- Re: AMBER: density problem Shulin Zhuang (Tue May 31 2005 - 20:49:47 CDT)
- Re: AMBER: Is the MD simulation normal JunJun Liu (Tue May 31 2005 - 21:01:07 CDT)
- Re: AMBER: Is the MD simulation normal Bill Ross (Tue May 31 2005 - 22:41:42 CDT)
Last message date: Sat Dec 31 2005 - 12:51:27 CST
Archived on: Sat Dec 31 2005 - 12:51:45 CST
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