File list

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This special page shows all uploaded files.

File list
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Date Name Thumbnail Size User Description Versions
17:20, 30 December 2009 Initial-minimization.inp (file) 642 bytes Tim input of initial minimization 1
17:06, 29 December 2009 Append.inp (file) 645 bytes Tim Append file for Crambin 1
17:06, 29 December 2009 Setup.inp (file) 939 bytes Tim setup file for crambin. 1
12:34, 31 December 2009 Final-minimization.inp (file) 2 KB Tim PBC minimization input file 1
17:07, 4 December 2013 QSAR 12.png (file) 2 KB Tim   1
12:49, 8 January 2010 Md-analysis.inp (file) 2 KB Tim Input file for analysis 1
22:15, 5 January 2010 Addions.str (file) 2 KB Tim addions stream file for neutralization 1
22:15, 5 January 2010 Md-heat.inp (file) 2 KB Tim MD heating file 1
20:01, 28 January 2009 1crn 1.inp (file) 3 KB Tim Stefan's first example input script for Crambin. 1
22:16, 5 January 2010 Md-equil.inp (file) 3 KB Tim MD equilibration script 1
16:49, 4 December 2013 SAR 12.png (file) 3 KB Tim   1
15:31, 31 December 2009 Solvate.inp (file) 3 KB Tim We don't need the label statement in this file... 2
17:04, 4 December 2013 QSAR 1.png (file) 4 KB Tim   1
17:53, 30 December 2009 Neutralize.inp (file) 4 KB Tim neutralization input file 1
14:38, 12 January 2016 DD walkthrough 14.jpg (file) 7 KB Tim   1
12:50, 8 January 2010 Md-analysis.out (file) 13 KB Tim Output from md-analysis 1
17:54, 30 December 2009 Neutralize.out (file) 15 KB Tim neutralization output file 1
15:18, 5 April 2014 Installer.sh (file) 18 KB Tim Installation file for CHARMMing. 1
12:35, 31 December 2009 Initital-minimization.out (file) 20 KB Tim Reverted to version as of 22:21, 30 December 2009 3
14:35, 12 January 2016 DD walkthrough 5.jpg (file) 23 KB Tim   1
14:37, 12 January 2016 DD walkthrough 11.jpg (file) 25 KB Tim   1
16:40, 17 March 2010 Graph-cutoff.png (file) 25 KB Tim Change ctonnb from 8 A to 12 A 5
18:33, 3 December 2013 SAR 3.png (file) 31 KB Tim   1
21:05, 3 December 2013 SAR 5.png (file) 34 KB Tim   1
17:05, 4 December 2013 QSAR 6.png (file) 35 KB Tim   1
01:11, 15 July 2008 Neut-output.png (file) 35 KB WikiSysop   1
01:07, 15 July 2008 Ourlogo.png (file) 35 KB WikiSysop   1
01:11, 15 July 2008 Header2.png (file) 35 KB WikiSysop   1
21:05, 3 December 2013 SAR 6.png (file) 37 KB Tim   1
17:05, 4 December 2013 QSAR 4.png (file) 37 KB Tim   1
17:05, 4 December 2013 QSAR 7.png (file) 38 KB Tim   1
17:07, 4 December 2013 QSAR 11.png (file) 38 KB Tim   1
17:05, 4 December 2013 QSAR 5.png (file) 39 KB Tim   1
17:04, 4 December 2013 QSAR 2.png (file) 44 KB Tim   1
12:35, 31 December 2009 Final-minimization.out (file) 45 KB Tim final PBC minimization output 1
20:00, 28 January 2009 1crn init.crd (file) 45 KB Tim Initial coordinates of 1CRN for Stefan's first CHARMM example. 1
21:05, 3 December 2013 SAR 4.png (file) 45 KB Tim   1
14:36, 12 January 2016 DD walkthrough 8.jpg (file) 45 KB Tim   1
17:11, 29 December 2009 1cbn-a.pdb (file) 50 KB Tim Parsed PDB file for 1CBN, segment A (no hetatoms) only. 1
16:34, 17 March 2010 Bullseye-cutoff.png (file) 50 KB Tim change ctonnb from 8 to 10 3
18:30, 3 December 2013 SAR 1.png (file) 50 KB Tim   1
17:07, 4 December 2013 QSAR 10.png (file) 53 KB Tim   1
12:48, 8 January 2010 Dcor.png (file) 54 KB Tim Time correlation function graph 1
16:49, 4 December 2013 SAR 11.png (file) 54 KB Tim   1
17:05, 4 December 2013 QSAR 3.png (file) 56 KB Tim   1
18:52, 16 June 2009 Images.png (file) 56 KB Hlwoodcock   2
14:35, 12 January 2016 DD walkthrough 4.jpg (file) 63 KB Tim   1
18:33, 3 December 2013 SAR 2.png (file) 66 KB Tim   1
17:05, 4 December 2013 QSAR 8.png (file) 71 KB Tim   1
17:06, 4 December 2013 QSAR 9.png (file) 72 KB Tim   1
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