Amber Archive Apr 2008 by messages with attachments
423 messages
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Starting
Fri Apr 18 2008 - 21:15:44 PDT,
Ending
Sun May 04 2008 - 06:07:15 PDT
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Re: AMBER: AMBER 9 testing
Taufik Al-Sarraj
(Wed Apr 02 2008 - 19:36:57 PDT)
taufik_alsarraj.vcf
(362 bytes)
AMBER: artifacts in ptraj avg output
stephane acoca
(Sat Apr 05 2008 - 01:46:55 PDT)
2PQK_protein_avg.pdb
(162411 bytes)
AMBER: protein-ligand complex problem
Lynn
(Thu Apr 10 2008 - 15:51:32 PDT)
2Fmo1.pdb
(159658 bytes)
2Fmo2.pdb
(161852 bytes)
Re: AMBER: questions about run MD at different pH
Taufik Al-Sarraj
(Tue Apr 15 2008 - 09:15:28 PDT)
taufik_alsarraj.vcf
(362 bytes)
Re: AMBER: questions about run MD at different pH
Taufik Al-Sarraj
(Tue Apr 15 2008 - 13:06:39 PDT)
taufik_alsarraj.vcf
(362 bytes)
Re: AMBER: questions about run MD at different pH
Taufik Al-Sarraj
(Tue Apr 15 2008 - 15:47:10 PDT)
taufik_alsarraj.vcf
(362 bytes)
Re: AMBER: hydrogens are flying in replica exchange simulations
Ashish Sangwai
(Mon Apr 21 2008 - 17:37:51 PDT)
1a.prmtop
(27540 bytes)
groupfile
(308 bytes)
inp.440
(276 bytes)
inp.eq
(254 bytes)
restrt0
(1836 bytes)
AMBER: Amber10 on Leopard with Intel compilers, "Undefined symbols" error
Yu Chen
(Wed Apr 23 2008 - 11:03:13 PDT)
config.h
(3099 bytes)
config_amber.h
(3435 bytes)
AMBER: saveamberparm
taufik.alsarraj.utoronto.ca
(Wed Apr 23 2008 - 17:34:02 PDT)
Simol2frominsight.mol2
(106071 bytes)
AMBER: Si parameters for MD (AMBER9)
Taufik Al-Sarraj
(Fri Apr 25 2008 - 15:08:44 PDT)
taufik_alsarraj.vcf
(362 bytes)
Re: RE: AMBER: memory usage
Ye Mei
(Sun Apr 27 2008 - 07:52:42 PDT)
files.zip
(138968 bytes)
Re: RE: RE: AMBER: memory usage
Ye Mei
(Mon Apr 28 2008 - 07:06:20 PDT)
config.h
(892 bytes)
AMBER: Cysteine sulphonic acid parameters
Rima Chaudhuri
(Wed Apr 30 2008 - 15:48:42 PDT)
CYO.mol2
(1551 bytes)
plp_only_test.pdb
(196865 bytes)
Last message date
:
Sun May 04 2008 - 06:07:15 PDT
Archived on
: Fri Sep 06 2024 - 05:53:40 PDT
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