Amber Archive Dec 2013 by messages with attachments
387 messages
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Starting
Sat Nov 30 2013 - 08:30:03 PST,
Ending
Tue Dec 31 2013 - 11:30:02 PST
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[AMBER] AMBER12 test discrepancy
Guanglei Cui
(Tue Dec 03 2013 - 07:55:44 PST)
11-21_14-40-30.diff
(1257 bytes)
11-21_14-40-30.log
(101440 bytes)
11-21_15-34-44.diff
(5013 bytes)
11-21_15-34-44.log
(22754 bytes)
[AMBER] Restrained MD with COM restraint with PMEMD
Mike Limb
(Tue Dec 03 2013 - 14:16:59 PST)
md_10ns.i
(323 bytes)
Re: [AMBER] Converting Amoeba .xyz for use with Amber
Eugene Yedvabny
(Mon Dec 09 2013 - 14:27:38 PST)
oxy.key
(88 bytes)
oxy_stripped.pdb
(11023 bytes)
oxy.pdb
(11023 bytes)
[AMBER] I got a error
David Chen
(Thu Dec 12 2013 - 04:22:58 PST)
no_mutate.pdb
(344527 bytes)
mutate_trp281.pdb
(343798 bytes)
[AMBER] I got a error
David Chen
(Fri Dec 13 2013 - 02:42:35 PST)
complex.pdb
(344527 bytes)
complex_mutate_tyr278.pdb
(343962 bytes)
Re: [AMBER] Converting Amoeba .xyz for use with Amber
Eugene Yedvabny
(Fri Dec 13 2013 - 14:08:40 PST)
oxy.analout
(168068 bytes)
Re: [AMBER] Converting Amoeba .xyz for use with Amber
case
(Sat Dec 14 2013 - 08:09:50 PST)
oxy.analout
(168069 bytes)
[AMBER] FINAL_RESULTS_MMPBSA error
filip fratev
(Thu Dec 19 2013 - 23:23:41 PST)
dec_test_80_kadyra.dat
(4604 bytes)
FINAL_RESULTS_MMPBSA.dat
(4592 bytes)
[AMBER] ErrorWithLeap
JAIME RUBIO MARTINEZ
(Mon Dec 23 2013 - 16:17:20 PST)
date_
(75569 bytes)
date_
(178 bytes)
date_
(434 bytes)
date_
(185 bytes)
date_
(423 bytes)
date_
(3623 bytes)
date_
(2789 bytes)
Re: [AMBER] capturing free energy landscape
anu chandra
(Thu Dec 26 2013 - 03:59:03 PST)
DeltG_landscape.png
(6809 bytes)
Re: [AMBER] Fwd:
Asfa Ali
(Thu Dec 26 2013 - 05:37:55 PST)
snapshot_com.all.out
(1757 bytes)
snapshot_lig.all.out
(1757 bytes)
snapshot_rec.all.out
(1757 bytes)
[AMBER] Problems about invoking AMBER12 in calculating binding energy
Yanyan ZHU
(Thu Dec 26 2013 - 18:19:00 PST)
QQ______20131227101423.jpg
(7945 bytes)
Re: [AMBER] unable to recognize Chlorine atom even after defining in lib and frcmod file
onetwo
(Thu Dec 26 2013 - 22:42:40 PST)
leap.log
(59978 bytes)
[AMBER] Problem when calculating MMPBSA
dongying0512
(Thu Dec 26 2013 - 22:53:49 PST)
inputs_and_results.rar
(530927 bytes)
Re: [AMBER] Problem when calculating MMPBSA (Jason Swails)
dongying0512
(Sun Dec 29 2013 - 17:21:37 PST)
files.rar
(711419 bytes)
Last message date
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Tue Dec 31 2013 - 11:30:02 PST
Archived on
: Wed Dec 11 2024 - 05:54:46 PST
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