Amber Archive Sep 2013 by messages with attachments

594 messages: Starting Sat Aug 31 2013 - 22:30:02 PDT, Ending Mon Sep 30 2013 - 20:00:04 PDT
This period: Most recent messages
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Re: [AMBER] mmP(G)BSA correlation time psu4.uic.edu (Thu Sep 05 2013 - 12:13:16 PDT)
1. 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)
1. try.png (233167 bytes)
Re: [AMBER] antechamber no convergence Jianhui Tian (Fri Sep 13 2013 - 07:18:51 PDT)
1. AMPPNP_withH_2.pdb (5083 bytes)
[AMBER] How to do clustering analysis by ptraj? Biao Ma (Tue Sep 17 2013 - 00:43:33 PDT)
1. bsub.log.3130.txt (620175 bytes)
2. pdb.list (17232 bytes)
3. pdb.list (17232 bytes)
Re: [AMBER] Antechamber Jasim, Mahmood (Student) (Tue Sep 17 2013 - 03:58:56 PDT)
1. complex.pdb (285505 bytes)
2. LIG.pdb (3150 bytes)
Re: [AMBER] Antechamber Jasim, Mahmood (Student) (Tue Sep 17 2013 - 05:09:21 PDT)
1. complex.pdb (285505 bytes)
2. LIG.pdb (3150 bytes)
3. LIG.prepin (3427 bytes)
4. LIG.frcmod (1130 bytes)
5. vac.inpcrd (249680 bytes)
Re: [AMBER] RESP_ A1-charge failed Shomesankar Bhunia (Thu Sep 19 2013 - 05:24:10 PDT)
1. Makefile (181 bytes)
Re: [AMBER] RESP_ A1-charge failed Shomesankar Bhunia (Thu Sep 19 2013 - 05:36:47 PDT)
1. 12.png (732220 bytes)
Re: [AMBER] MMPBSA/GBSA error Sumra Wajid Abbasi 30-FBAS/MSBI/F09 (Thu Sep 19 2013 - 06:56:11 PDT)
1. ligand1.tif (80810 bytes)
Re: [AMBER] MMPBSA/GBSA error Sumra Wajid Abbasi 30-FBAS/MSBI/F09 (Thu Sep 19 2013 - 07:54:07 PDT)
1. _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)
1. _MMPBSA_ligand.mdcrd.0 (153181 bytes)
2. unk.prmtop (65241 bytes)
Re: [AMBER] MMPBSA/GBSA error Jason Swails (Thu Sep 19 2013 - 12:06:44 PDT)
1. molecule.png (115882 bytes)
Re: [AMBER] MMPBSA/GBSA error wmsmith.uci.edu (Thu Sep 19 2013 - 18:05:08 PDT)
1. 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)
1. 2drms.png (6452 bytes)
[AMBER] problem running antechamber - amber Version 10 Concha, Monica (Wed Sep 25 2013 - 07:17:03 PDT)
1. chemx.pdb (23233 bytes)
Re: [AMBER] How to do clustering analysis by ptraj? Biao Ma (Wed Sep 25 2013 - 19:18:29 PDT)
1. hpcs_cpuinfo.txt (201480 bytes)