User contributions for Rgc
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21 October 2010
- 23:3323:33, 21 October 2010 diff hist 0 Tutorials No edit summary
- 23:3323:33, 21 October 2010 diff hist +23 Tutorials No edit summary
- 23:3323:33, 21 October 2010 diff hist +24 Pymol background No edit summary
7 October 2010
- 20:2020:20, 7 October 2010 diff hist +46 N Shoichet Lab Photos No edit summary
22 September 2010
- 17:4317:43, 22 September 2010 diff hist +9 Cluster Usage No edit summary
15 September 2010
- 21:4021:40, 15 September 2010 diff hist +377 Cluster Usage No edit summary
3 September 2010
- 21:2221:22, 3 September 2010 diff hist +25 Mol2db2 Format 2 adding hydrogen set data
31 August 2010
- 20:0520:05, 31 August 2010 diff hist +4 Dock development No edit summary
- 20:0520:05, 31 August 2010 diff hist +16 Dock development No edit summary
- 20:0420:04, 31 August 2010 diff hist +528 N Dock development No edit summary
22 July 2010
- 18:1218:12, 22 July 2010 diff hist +385 Flexible docking code No edit summary
- 18:1018:10, 22 July 2010 diff hist +204 N Flexible docking code temp
19 July 2010
- 19:4019:40, 19 July 2010 diff hist +50 Hit picking party →Before the party
- 19:4019:40, 19 July 2010 diff hist −49 Hit picking party →During the party
- 17:4817:48, 19 July 2010 diff hist +41 CSD No edit summary
18 July 2010
- 20:0620:06, 18 July 2010 diff hist +49 Hit picking party →During the party
- 20:0520:05, 18 July 2010 diff hist +17 N Csd Csd moved to CSD
- 20:0520:05, 18 July 2010 diff hist 0 m CSD Csd moved to CSD
- 20:0520:05, 18 July 2010 diff hist +202 N CSD No edit summary
24 June 2010
- 00:4400:44, 24 June 2010 diff hist +7 m ROCS formatting
- 00:4300:43, 24 June 2010 diff hist +25 m ROCS categorizing
- 00:4300:43, 24 June 2010 diff hist +208 ROCS adding useful links
23 June 2010
- 22:3622:36, 23 June 2010 diff hist +176 Nm ROCS new page
- 22:3522:35, 23 June 2010 diff hist +4 m Shape based methods adding link to rocs page
16 June 2010
- 23:3323:33, 16 June 2010 diff hist −9,171 m Cluster 3 Reverted edits by Dizik (Talk); changed back to last version by Suhaib
15 June 2010
- 22:4822:48, 15 June 2010 diff hist +197 N SciFinder new page about scifinder
18 May 2010
- 18:0018:00, 18 May 2010 diff hist −2 m Mol2db2 Format 2 stupid newline
- 17:3417:34, 18 May 2010 diff hist +250 Mol2db2 Format 2 adding 2 more lines to the molecule entry
13 May 2010
- 18:2918:29, 13 May 2010 diff hist 0 m Mol2db2 Format 2 adding 3 missing columns to setid
6 May 2010
- 23:3723:37, 6 May 2010 diff hist +1 m DOCK Blaster:Prepare Input broken link
- 23:3723:37, 6 May 2010 diff hist +1 m DOCK Blaster:Prepare Input link broken
- 21:0121:01, 6 May 2010 diff hist +171 Cluster Usage adding some information. almost nothing here.
- 16:1416:14, 6 May 2010 diff hist −79 m ZINC Database Reverted edits by Paola mybhaby (Talk); changed back to last version by Frodo
22 April 2010
- 17:1217:12, 22 April 2010 diff hist +60 m Mol2db2 Format 2 adding coord nums to conf output
- 17:0517:05, 22 April 2010 diff hist +29 m Mol2db2 Format 2 adding coordinate number
20 April 2010
- 21:2321:23, 20 April 2010 diff hist +1,716 m Mol2db2 Format 2 adding fortran format lines
- 19:0119:01, 20 April 2010 diff hist −16 m Mol2db2 Format 2 copy/paste typo
- 18:5218:52, 20 April 2010 diff hist +83 m Mol2db2 Format 2 adding forgotten set lines
19 April 2010
- 19:5419:54, 19 April 2010 diff hist +1 m Mol2db2 Format 2 end line for end line
- 19:5319:53, 19 April 2010 diff hist +28 m Mol2db2 Format 2 adding an end line
- 18:4518:45, 19 April 2010 diff hist −7 m Mol2db2 Format 2 left justify color names
- 16:3116:31, 19 April 2010 diff hist +18 m Mol2db2 Format 2 final bit about sets
17 April 2010
- 02:4902:49, 17 April 2010 diff hist +2 m Mol2db2 Format 2 not quite done
16 April 2010
- 23:1023:10, 16 April 2010 diff hist −3 m Mol2db2 Format 2 tiny edit
- 22:5922:59, 16 April 2010 diff hist +1 m Mol2db2 Format 2 changing alignment of text fields
- 22:5422:54, 16 April 2010 diff hist +70 m Mol2db2 Format 2 conf lines
- 22:2822:28, 16 April 2010 diff hist +216 m Mol2db2 Format 2 even more python format lines
- 18:5518:55, 16 April 2010 diff hist +57 m Mol2db2 Format 2 xyz python line
- 17:5917:59, 16 April 2010 diff hist 0 m Mol2db2 Format 2 fixing python lines
- 17:5817:58, 16 April 2010 diff hist 0 m Mol2db2 Format 2 editing things to make output sensible
- 17:5217:52, 16 April 2010 diff hist +64 m Mol2db2 Format 2 atom line, including changes
- 17:5017:50, 16 April 2010 diff hist +56 m Mol2db2 Format 2 adding to atom line
- 17:4417:44, 16 April 2010 diff hist +44 m Mol2db2 Format 2 more lines
15 April 2010
- 23:3023:30, 15 April 2010 diff hist +36 m Mol2db2 Format 2 first molecule line
- 21:5421:54, 15 April 2010 diff hist +79 m Mol2db2 Format 2 beginning to copy/paste format statements
- 21:4421:44, 15 April 2010 diff hist +285 m Mol2db2 Format 2 implicit type lines
- 18:0818:08, 15 April 2010 diff hist +94 m Mol2db2 Format 2 done for now
- 18:0318:03, 15 April 2010 diff hist +137 m Mol2db2 Format 2 sets changed
- 17:5817:58, 15 April 2010 diff hist +313 m Mol2db2 Format 2 stuck on sets
- 17:5117:51, 15 April 2010 diff hist +195 m Mol2db2 Format 2 more
- 17:4717:47, 15 April 2010 diff hist +88 m Mol2db2 Format 2 atoms and bonds
- 17:4117:41, 15 April 2010 diff hist +141 m Mol2db2 Format 2 working through columns
- 17:1117:11, 15 April 2010 diff hist +307 m Mol2db2 Format 2 column work
- 16:5116:51, 15 April 2010 diff hist +126 m Mol2db2 Format 2 lots more things necessary to read in easily in fortran
- 16:4716:47, 15 April 2010 diff hist +77 m Mol2db2 Format 2 reworking file format
- 00:3600:36, 15 April 2010 diff hist +520 Mol2db2 Format 2 preliminary file format
6 April 2010
- 20:3120:31, 6 April 2010 diff hist +18 m Mol2db2 Format 2 mmm's suggestion
5 April 2010
- 17:0917:09, 5 April 2010 diff hist +18 m Visualizing delphi more categories
- 17:0817:08, 5 April 2010 diff hist +25 m Visualizing delphi adding categories
2 April 2010
- 23:1223:12, 2 April 2010 diff hist −49 m DUMM6 →Slides: removing duplicates
- 21:3721:37, 2 April 2010 diff hist +9 m DUMM6 →Slides: fixing error
- 16:1916:19, 2 April 2010 diff hist +35 m DUMM6 formatting
- 16:1816:18, 2 April 2010 diff hist +161 m DUMM6 update
- 00:0500:05, 2 April 2010 diff hist +899 DUMM6 adding slides
1 April 2010
- 16:2916:29, 1 April 2010 diff hist +11 m Visualizing delphi cutesy tagging
- 15:5215:52, 1 April 2010 diff hist +1 m Visualizing delphi fixing
- 15:5115:51, 1 April 2010 diff hist 0 m Visualizing delphi fixing
- 15:5115:51, 1 April 2010 diff hist 0 m Visualizing delphi changing image name
- 15:5015:50, 1 April 2010 diff hist +55 m Visualizing delphi thumbnail images
- 15:4715:47, 1 April 2010 diff hist +193 Visualizing delphi final note, anthropomorphizing the scoring function
- 15:4515:45, 1 April 2010 diff hist +898 Visualizing delphi updating page with screenshots
31 March 2010
- 22:0422:04, 31 March 2010 diff hist +126 m Mol2db2 Format 2 peter kolb's suggestions
- 21:3121:31, 31 March 2010 diff hist 0 m Mol2db2 Format 2 Flexibase Format 2 moved to Mol2db Format 2: name change, not sure why we use flexibase
- 21:3121:31, 31 March 2010 diff hist +29 N Flexibase Format 2 Flexibase Format 2 moved to Mol2db Format 2: name change, not sure why we use flexibase
- 21:2721:27, 31 March 2010 diff hist +84 m Mol2db2 Format 2 update to match online with notebook
- 17:2017:20, 31 March 2010 diff hist +10 m Dock Users' Meeting Minutes (DUMM) update date
30 March 2010
- 19:0019:00, 30 March 2010 diff hist −4 m Visualizing delphi formatting
- 19:0019:00, 30 March 2010 diff hist 0 m Visualizing delphi numbers
- 18:5918:59, 30 March 2010 diff hist +144 m Visualizing delphi beginning of outline
- 18:5818:58, 30 March 2010 diff hist +4 m Visualizing delphi new page, i'll finish this eventually
- 18:5818:58, 30 March 2010 diff hist +120 N Visualizing delphi new page, i'll finish this eventually
- 18:5718:57, 30 March 2010 diff hist +110 Delphi adding a link to a visualization of delphi tutorial
29 March 2010
- 20:5120:51, 29 March 2010 diff hist +80 m Travel Depth →Ligand Volume/Surface Area: explanation of environment setup
- 17:5817:58, 29 March 2010 diff hist +2 m Travel Depth moving toc
- 17:5817:58, 29 March 2010 diff hist +27 m Travel Depth →Ligand Volume/Surface Area
- 16:4216:42, 29 March 2010 diff hist +271 Travel Depth →Ligand Volume/Surface Area: bondi radii description
- 16:4016:40, 29 March 2010 diff hist +14 m Travel Depth adding toc
- 16:3816:38, 29 March 2010 diff hist +674 Travel Depth adding ligand volume description
- 16:3516:35, 29 March 2010 diff hist +23 m Travel Depth adding headings
26 March 2010
- 00:4700:47, 26 March 2010 diff hist +53 Nm MODBASE adding a link to modbase
19 March 2010
- 22:5222:52, 19 March 2010 diff hist 0 m DUMM6 formatting
- 22:5022:50, 19 March 2010 diff hist +18 m Dock Users' Meeting Minutes (DUMM) No edit summary
- 22:4922:49, 19 March 2010 diff hist +287 N DUMM6 making a page for the next as yet unscheduled DUMM meeting
18 March 2010
- 22:4322:43, 18 March 2010 diff hist +19 m Tutorials categorizing
- 22:4222:42, 18 March 2010 diff hist +45 m Travel Depth categorizing
- 17:5517:55, 18 March 2010 diff hist −1 m Travel Depth formatting
- 17:5517:55, 18 March 2010 diff hist +14 m Travel Depth formatting
- 17:5417:54, 18 March 2010 diff hist +1 m Travel Depth formatting sucks
- 17:4817:48, 18 March 2010 diff hist +63 m Travel Depth adding tstconvexhull explanation
17 March 2010
- 21:5821:58, 17 March 2010 diff hist +54 2D to 3D adding a 3d molecule generation tool that i saw in literature
- 17:0917:09, 17 March 2010 diff hist −42 m DOCK Overview formatting
- 01:4001:40, 17 March 2010 diff hist −9 m Vdw.defn formatting
- 01:3801:38, 17 March 2010 diff hist +4 m Travel Depth formatting
- 01:2001:20, 17 March 2010 diff hist +8 m Travel Depth formatting
- 01:2001:20, 17 March 2010 diff hist +2,877 N Travel Depth adding a page about the travel depth code from the sharp lab
16 March 2010
- 01:5801:58, 16 March 2010 diff hist −111 m Flex drive.tbl formatting
- 01:5601:56, 16 March 2010 diff hist −57 m FAQ:mmolex formatting
15 March 2010
- 22:0822:08, 15 March 2010 diff hist −16 m Showbox fixing formatting
- 22:0622:06, 15 March 2010 diff hist −56 m Parameter Parser formatting fixups
- 22:0122:01, 15 March 2010 diff hist +1 m Sphere Matching fixing formatting
- 22:0122:01, 15 March 2010 diff hist −32 m Sphere Matching fixing formatting
5 March 2010
- 18:5018:50, 5 March 2010 diff hist +22 Db2multipdb.py i guess this is a tutorial now
- 18:4618:46, 5 March 2010 diff hist +21 Tutorials adding db2multipdb.py decoder ring to tutorials page
3 March 2010
- 18:5618:56, 3 March 2010 diff hist +1 Flexibase Format correcting documentation since partial charges are actually multiplied by 10000 not 1000.
28 February 2010
- 22:3122:31, 28 February 2010 diff hist +36 DOCK:Problems →DOCK 3.5.54
16 February 2010
- 19:0019:00, 16 February 2010 diff hist +36 m DOCK:Problems →DOCK 3.5.54
20 January 2010
- 19:3319:33, 20 January 2010 diff hist +154 m Flexibase Format adding note about the column spacing being wrong
- 19:2319:23, 20 January 2010 diff hist 0 m Flexibase Format No edit summary
- 19:2019:20, 20 January 2010 diff hist −116 Flexibase Format fixing carriage returns
7 January 2010
- 02:0702:07, 7 January 2010 diff hist +139 Mol2db clarifying mol2db changes
10 December 2009
- 23:1423:14, 10 December 2009 diff hist +307 m Db2multipdb.py explaining error precedence
- 23:1023:10, 10 December 2009 diff hist +22 m Db2multipdb.py No edit summary
- 23:0523:05, 10 December 2009 diff hist +24 m Db2multipdb.py changing formatting
- 23:0523:05, 10 December 2009 diff hist +610 Db2multipdb.py talking about pdb file output
- 23:0123:01, 10 December 2009 diff hist +5 m Db2multipdb.py No edit summary
- 23:0023:00, 10 December 2009 diff hist 0 m Db2multipdb.py No edit summary
- 23:0023:00, 10 December 2009 diff hist +13 m Db2multipdb.py link to author page
- 22:5922:59, 10 December 2009 diff hist +1,148 Db2multipdb.py full description of program
- 22:4722:47, 10 December 2009 diff hist +63 m Db2multipdb.py script location
- 22:4722:47, 10 December 2009 diff hist 0 m Db2multipdb.py link to flexibase page
- 22:4622:46, 10 December 2009 diff hist +21 m Db2multipdb.py link to flexibase page
- 22:4522:45, 10 December 2009 diff hist −9 Db2multipdb.py new file describing db2multipdb.py
- 22:4522:45, 10 December 2009 diff hist +466 N Db2multipdb.py new file describing db2multipdb.py
- 22:4222:42, 10 December 2009 diff hist +73 Mol2db adding link to new decoder tool
9 December 2009
- 20:0420:04, 9 December 2009 diff hist +354 Mol2db explaining distance tolerance
30 November 2009
- 22:1222:12, 30 November 2009 diff hist +368 N Mol2db2 Format 2 new page about wishlist of features for mol2db/dock flexibase format
24 November 2009
- 21:2821:28, 24 November 2009 diff hist +48 Mol2db changing to reflect new bugfix
18 November 2009
- 17:1217:12, 18 November 2009 diff hist +107 Mol2db adding fix to multiple atom checks per level.
17 November 2009
- 20:1120:11, 17 November 2009 diff hist −204 PBSA Score hopefully formatting this page correctly
- 20:0520:05, 17 November 2009 diff hist +4 m Mol2db making links correct
- 20:0520:05, 17 November 2009 diff hist 0 m Mol2db No edit summary
- 19:0119:01, 17 November 2009 diff hist +321 Mol2db saving realization about source of bugs in confhier.c
- 03:2303:23, 17 November 2009 diff hist +55 Mol2db No edit summary
- 02:3802:38, 17 November 2009 diff hist −3 Mol2db ordered lists
- 02:3502:35, 17 November 2009 diff hist +333 Mol2db better description
- 02:3002:30, 17 November 2009 diff hist +150 Mol2db describing algorithm in hiergen.
14 November 2009
- 00:4700:47, 14 November 2009 diff hist +117 Mol2db hiergen.c update
13 November 2009
- 22:2122:21, 13 November 2009 diff hist +57 m Mol2db No edit summary
- 17:2217:22, 13 November 2009 diff hist +89 m Mol2db clarification of purpose
- 17:2217:22, 13 November 2009 diff hist +191 N Mol2db initial mol2db page
10 November 2009
- 22:5422:54, 10 November 2009 diff hist +58 Flexibase Format calling the conformation tree output order infix, helpful word to google for more info.
- 01:5501:55, 10 November 2009 diff hist +173 Mol2 adding presumptions about multimol2 formatting
- 01:3701:37, 10 November 2009 diff hist −12 Mol2 removing whitespace from beginning of lines
- 01:3001:30, 10 November 2009 diff hist −11 Flexibase Format fixing example file spacing
- 01:2901:29, 10 November 2009 diff hist +601 Flexibase Format adding some descriptions as to how the atom coordinates/conformations are stored
- 01:1901:19, 10 November 2009 diff hist −21 Flexibase Format removing whitespace from beginning of lines
- 01:1801:18, 10 November 2009 diff hist +27 Flexibase Format changing code block to be a code block, adding details about atom coordinates