User contributions for Dave

12:2212:22, 11 November 2013 diff hist −12 MotiveValidator No edit summary
12:2212:22, 11 November 2013 diff hist +14 MotiveValidator No edit summary
12:2112:21, 11 November 2013 diff hist +145 N MotiveValidator Created page with "== Overview == TODO == Documentation == * Tutorial * FAQ * Help"

19:4919:49, 6 November 2013 diff hist +36 Mole 2.5 No edit summary current
19:4819:48, 6 November 2013 diff hist +23 Mole 2.5 No edit summary
19:4719:47, 6 November 2013 diff hist +595 N Mole 2.5 Created page with "== What's New == * Charge computation on channel surfaces and centerlines (from potential on grid or atom values). * Lining residues and physico-chemical properties for cavit..."
19:3219:32, 6 November 2013 diff hist −2 Mole 2.5 Command Line Output Help No edit summary
19:3219:32, 6 November 2013 diff hist +63 Mole 2.5 Command Line Output Help No edit summary
19:2719:27, 6 November 2013 diff hist +2,862 Mole 2.5 Command Line Output Help No edit summary
19:0819:08, 6 November 2013 diff hist +5,294 N Mole 2.5 Command Line Output Help Created page with "== Output Types == Mole 2.5 Command Line generates these types of output: * XML for Channels (Tunnels, Pores, Paths), Cavities, Charges, and Start Points. * PDB for Channel ..."
17:1617:16, 6 November 2013 diff hist +118 Mole 2.5 Command Line Input Help No edit summary

17:2017:20, 5 November 2013 diff hist −169 Mole 2.5 Command Line Input Help No edit summary
17:1317:13, 5 November 2013 diff hist +8,410 N Mole 2.5 Command Line Input Help Created page with "== General XML input shape == <pre> <Tunnels> <Input Attributes="...">filename</Input> <ChargeSources> <ScalarGrid Attributes="..." /> <AtomValues Attributes="..."..."

22:1422:14, 7 June 2013 diff hist +122 News →MotiveQuery
22:1322:13, 7 June 2013 diff hist +52 PatternQuery:Language Reference No edit summary
03:2503:25, 7 June 2013 diff hist −685 PatternQuery:Language Reference No edit summary
03:2103:21, 7 June 2013 diff hist +26,657 N PatternQuery:Language Reference Created page with "== Introduction == DISCLAIMER: This is an early version of the MotiveQuery language. There is probably a lot of bugs. Individual function names and syntax are all subject to ..."
03:2003:20, 7 June 2013 diff hist +3,347 N How to's Created page with "== SiteBinder == === Select all structures that have exactly one C<sub>5</sub>O ring === Enter <code>Current().Count(Rings(5 * ["C"] + ["O"])) == 1</code> into the Structure..."
03:2003:20, 7 June 2013 diff hist +1,549 N News Created page with "== SiteBinder == '''v2.13.5.22''' (22.5.2013) * An option to group structures by selected atoms. * Fixed a bug in the Combinatorial method that made it slower than it should ..."
03:2003:20, 7 June 2013 diff hist −432 Main Page No edit summary