http://wiki.docking.org/index.php?action=history&feed=atom&title=Docktools 2026-04-04T18:09:03Z Revision history for this page on the wiki MediaWiki 1.39.1 http://wiki.docking.org/index.php?title=Docktools&diff=1461&oldid=prev 2012-10-08T20:11:55Z

<p>2 revisions</p> <table style="background-color: #fff; color: #202122;" data-mw="interface"> <tr class="diff-title" lang="en"> <td colspan="1" style="background-color: #fff; color: #202122; text-align: center;">← Older revision</td> <td colspan="1" style="background-color: #fff; color: #202122; text-align: center;">Revision as of 20:11, 8 October 2012</td> </tr><tr><td colspan="2" class="diff-notice" lang="en"><div class="mw-diff-empty">(No difference)</div> </td></tr></table>

Therese http://wiki.docking.org/index.php?title=Docktools&diff=1460&oldid=prev 2007-09-21T18:36:02Z

<p></p> <table style="background-color: #fff; color: #202122;" data-mw="interface"> <col class="diff-marker" /> <col class="diff-content" /> <col class="diff-marker" /> <col class="diff-content" /> <tr class="diff-title" lang="en"> <td colspan="2" style="background-color: #fff; color: #202122; text-align: center;">← Older revision</td> <td colspan="2" style="background-color: #fff; color: #202122; text-align: center;">Revision as of 18:36, 21 September 2007</td> </tr><tr><td colspan="2" class="diff-lineno" id="mw-diff-left-l1">Line 1:</td> <td colspan="2" class="diff-lineno">Line 1:</td></tr> <tr><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>Docktools is a suite of programs that are available to create grids used by Dock3.5 score function in DOCK 6 which is an implementation of the scoring function available in the older version of DOCK i.e., dock3.5.54. These programs can be used to generate steric, electrostatic and ligand and receptor desolvation grids. Dock3.5 scoring functionality in DOCK 6 is an alternate scoring approach to electrostatic interaction energy and also includes different grid-based methods for calculating ligand and receptor desolvation. Docktools consists of chemgrid, solvmap, solvgrid, grid-convert and grid-convrds.  This section will briefly review the theory behind each of the programs and the describe the usage.</div></td><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>Docktools is a suite of programs that are available to create grids used by Dock3.5 score function in DOCK 6 which is an implementation of the scoring function available in the older version of DOCK i.e., dock3.5.54. These programs can be used to generate steric, electrostatic and ligand and receptor desolvation grids. Dock3.5 scoring functionality in DOCK 6 is an alternate scoring approach to electrostatic interaction energy and also includes different grid-based methods for calculating ligand and receptor desolvation. Docktools consists of chemgrid, solvmap, solvgrid, grid-convert and grid-convrds.  This section will briefly review the theory behind each of the programs and the describe the usage.</div></td></tr> <tr><td colspan="2" class="diff-side-deleted"></td><td class="diff-marker" data-marker="+"></td><td style="color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #a3d3ff; vertical-align: top; white-space: pre-wrap;"><div><ins style="font-weight: bold; text-decoration: none;"></ins></div></td></tr> <tr><td colspan="2" class="diff-side-deleted"></td><td class="diff-marker" data-marker="+"></td><td style="color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #a3d3ff; vertical-align: top; white-space: pre-wrap;"><div><ins style="font-weight: bold; text-decoration: none;"></ins></div></td></tr> <tr><td colspan="2" class="diff-side-deleted"></td><td class="diff-marker" data-marker="+"></td><td style="color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #a3d3ff; vertical-align: top; white-space: pre-wrap;"><div><ins style="font-weight: bold; text-decoration: none;">[[Category:Software]]</ins></div></td></tr> <!-- diff cache key wikidb:diff::1.12:old-1459:rev-1460 --> </table>

JohnIrwin http://wiki.docking.org/index.php?title=Docktools&diff=1459&oldid=prev 2006-09-19T23:01:13Z

<p></p> <p><b>New page</b></p><div>Docktools is a suite of programs that are available to create grids used by Dock3.5 score function in DOCK 6 which is an implementation of the scoring function available in the older version of DOCK i.e., dock3.5.54. These programs can be used to generate steric, electrostatic and ligand and receptor desolvation grids. Dock3.5 scoring functionality in DOCK 6 is an alternate scoring approach to electrostatic interaction energy and also includes different grid-based methods for calculating ligand and receptor desolvation. Docktools consists of chemgrid, solvmap, solvgrid, grid-convert and grid-convrds. This section will briefly review the theory behind each of the programs and the describe the usage.</div>

JohnIrwin