Amber Archive Sep 2013 by messages with attachments
594 messages
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Starting
Sat Aug 31 2013 - 22:30:02 PDT,
Ending
Mon Sep 30 2013 - 20:00:04 PDT
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Re: [AMBER] mmP(G)BSA correlation time
psu4.uic.edu
(Thu Sep 05 2013 - 12:13:16 PDT)
correlation_time_plot.JPG
(26188 bytes)
Re: [AMBER] For format correction after generating solvent file.
Krati Sharma
(Fri Sep 06 2013 - 07:33:05 PDT)
try.png
(233167 bytes)
Re: [AMBER] antechamber no convergence
Jianhui Tian
(Fri Sep 13 2013 - 07:18:51 PDT)
AMPPNP_withH_2.pdb
(5083 bytes)
[AMBER] How to do clustering analysis by ptraj?
Biao Ma
(Tue Sep 17 2013 - 00:43:33 PDT)
bsub.log.3130.txt
(620175 bytes)
pdb.list
(17232 bytes)
pdb.list
(17232 bytes)
Re: [AMBER] Antechamber
Jasim, Mahmood (Student)
(Tue Sep 17 2013 - 03:58:56 PDT)
complex.pdb
(285505 bytes)
LIG.pdb
(3150 bytes)
Re: [AMBER] Antechamber
Jasim, Mahmood (Student)
(Tue Sep 17 2013 - 05:09:21 PDT)
complex.pdb
(285505 bytes)
LIG.pdb
(3150 bytes)
LIG.prepin
(3427 bytes)
LIG.frcmod
(1130 bytes)
vac.inpcrd
(249680 bytes)
Re: [AMBER] RESP_ A1-charge failed
Shomesankar Bhunia
(Thu Sep 19 2013 - 05:24:10 PDT)
Makefile
(181 bytes)
Re: [AMBER] RESP_ A1-charge failed
Shomesankar Bhunia
(Thu Sep 19 2013 - 05:36:47 PDT)
12.png
(732220 bytes)
Re: [AMBER] MMPBSA/GBSA error
Sumra Wajid Abbasi 30-FBAS/MSBI/F09
(Thu Sep 19 2013 - 06:56:11 PDT)
ligand1.tif
(80810 bytes)
Re: [AMBER] MMPBSA/GBSA error
Sumra Wajid Abbasi 30-FBAS/MSBI/F09
(Thu Sep 19 2013 - 07:54:07 PDT)
_MMPBSA_ligand_pb.mdout.0
(32773 bytes)
Re: [AMBER] MMPBSA/GBSA error
Sumra Wajid Abbasi 30-FBAS/MSBI/F09
(Thu Sep 19 2013 - 08:18:35 PDT)
_MMPBSA_ligand.mdcrd.0
(153181 bytes)
unk.prmtop
(65241 bytes)
Re: [AMBER] MMPBSA/GBSA error
Jason Swails
(Thu Sep 19 2013 - 12:06:44 PDT)
molecule.png
(115882 bytes)
Re: [AMBER] MMPBSA/GBSA error
wmsmith.uci.edu
(Thu Sep 19 2013 - 18:05:08 PDT)
09-19_at_6.01.34_PM.png
(15451 bytes)
Re: [AMBER] How to do clustering analysis by ptraj?
Biao Ma
(Thu Sep 19 2013 - 23:56:34 PDT)
2drms.png
(6452 bytes)
[AMBER] problem running antechamber - amber Version 10
Concha, Monica
(Wed Sep 25 2013 - 07:17:03 PDT)
chemx.pdb
(23233 bytes)
Re: [AMBER] How to do clustering analysis by ptraj?
Biao Ma
(Wed Sep 25 2013 - 19:18:29 PDT)
hpcs_cpuinfo.txt
(201480 bytes)
Last message date
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Mon Sep 30 2013 - 20:00:04 PDT
Archived on
: Fri Dec 13 2024 - 05:54:52 PST
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