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User contributions for Vhc08

Results for Vhc08 talk block log uploads logs

A user with 135 edits. Account created on 15 June 2012.

08:5808:58, 10 September 2013 diff hist +13 Talk:Mod:Hunt Research Group/ChemShell Introduction No edit summary
00:3100:31, 10 September 2013 diff hist +6 Talk:Mod:Hunt Research Group/ChemShell Introduction No edit summary
00:3100:31, 10 September 2013 diff hist −2 Talk:Mod:Hunt Research Group/ChemShell Introduction No edit summary
00:3000:30, 10 September 2013 diff hist +181 Talk:Mod:Hunt Research Group/ChemShell Introduction No edit summary
00:2700:27, 10 September 2013 diff hist +47 Talk:Mod:Hunt Research Group/ChemShell Introduction No edit summary
00:1100:11, 10 September 2013 diff hist +1,356 Talk:Mod:Hunt Research Group/ChemShell Introduction No edit summary

22:5522:55, 9 September 2013 diff hist +1 Talk:Mod:Hunt Research Group/ChemShell Introduction No edit summary
22:5522:55, 9 September 2013 diff hist +343 N Talk:Mod:Hunt Research Group/ChemShell Introduction Created page with "This tutorial will outline the basics of ChemShell leading to a QM/MM calculation of copper(II) and 2 solvation shells. In order you run ChemShell, you will have to login to cx1..."

15:1115:11, 6 September 2013 diff hist +150 Mod:Hunt Research Group →Running QM/MM Simulations in ChemShell
13:4313:43, 6 September 2013 diff hist +14 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
13:4213:42, 6 September 2013 diff hist −25 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
13:4213:42, 6 September 2013 diff hist +94 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
13:4013:40, 6 September 2013 diff hist −2 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
13:4013:40, 6 September 2013 diff hist +488 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
13:3013:30, 6 September 2013 diff hist +14 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
13:2613:26, 6 September 2013 diff hist +4,095 Talk:Mod:Hunt Research Group/ChemShell System Aqeuous Cu(II) No edit summary

09:1409:14, 30 July 2013 diff hist −19 Mod:Hunt Research Group →Running QM/MM Simulations in ChemShell
08:5008:50, 30 July 2013 diff hist +950 Talk:Mod:Hunt Research Group/QMMM OPT Aqeuous Cu(II) No edit summary
08:4608:46, 30 July 2013 diff hist +166 Talk:Mod:Hunt Research Group/QMMM MD Aqeuous Cu(II) No edit summary
08:4508:45, 30 July 2013 diff hist +132 Talk:Mod:Hunt Research Group/ChemShell cx1 No edit summary current
08:4408:44, 30 July 2013 diff hist +25 Talk:Mod:Hunt Research Group/ChemShell cx1 No edit summary
08:4108:41, 30 July 2013 diff hist +89 Talk:Mod:Hunt Research Group/QMMM SP Aqeuous Cu(II) No edit summary
08:3608:36, 30 July 2013 diff hist +18 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
08:3508:35, 30 July 2013 diff hist +11 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
08:3508:35, 30 July 2013 diff hist +99 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
08:3408:34, 30 July 2013 diff hist +53 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
08:3408:34, 30 July 2013 diff hist +31 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
08:3308:33, 30 July 2013 diff hist +5 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
08:3308:33, 30 July 2013 diff hist +459 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
08:1908:19, 30 July 2013 diff hist −2 Talk:Mod:Hunt Research Group/ChemShell cx1 No edit summary
08:1808:18, 30 July 2013 diff hist +92 Talk:Mod:Hunt Research Group/ChemShell cx1 No edit summary
08:0808:08, 30 July 2013 diff hist −15 Talk:Mod:Hunt Research Group/ChemShell cx1 No edit summary
08:0808:08, 30 July 2013 diff hist −6 Talk:Mod:Hunt Research Group/ChemShell cx1 No edit summary
08:0708:07, 30 July 2013 diff hist +522 Talk:Mod:Hunt Research Group/ChemShell cx1 No edit summary

18:4418:44, 29 July 2013 diff hist +1,013 N Talk:Mod:Hunt Research Group/ChemShell cx1 Created page with "Here's an example submit script to run the QM/MM single point energy calculation from [https://wiki.ch.ic.ac.uk/wiki/index.php?title=Talk:Mod:Hunt_Research_Group/QMMM_SP_Aqeuous_..."
18:3218:32, 29 July 2013 diff hist +4,091 Talk:Mod:Hunt Research Group/QMMM OPT Aqeuous Cu(II) No edit summary
18:3018:30, 29 July 2013 diff hist −1 Talk:Mod:Hunt Research Group/QMMM SP Aqeuous Cu(II) No edit summary
18:3018:30, 29 July 2013 diff hist −4 Talk:Mod:Hunt Research Group/QMMM SP Aqeuous Cu(II) No edit summary
18:3018:30, 29 July 2013 diff hist −40,932 Talk:Mod:Hunt Research Group/QMMM SP Aqeuous Cu(II) No edit summary
18:2918:29, 29 July 2013 diff hist +41,304 Talk:Mod:Hunt Research Group/QMMM SP Aqeuous Cu(II) No edit summary
18:2718:27, 29 July 2013 diff hist −36 Talk:Mod:Hunt Research Group/QMMM OPT Aqeuous Cu(II) No edit summary
18:2318:23, 29 July 2013 diff hist −1,239 Talk:Mod:Hunt Research Group/QMMM SP Aqeuous Cu(II) No edit summary
18:2118:21, 29 July 2013 diff hist +136 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
18:1718:17, 29 July 2013 diff hist −5 Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) No edit summary
18:1618:16, 29 July 2013 diff hist +1,086 N Talk:Mod:Hunt Research Group/ChemShell Force Field Parameters Aqueous Cu(II) Created page with " <pre> read_input ff.dat { vdw cu cu 62.99111 19858.39 vdw cu o 204.1966 118331.2 vdw cu h 0.000000 0.000000 vdw o o 626.00 630437.34 vdw o h 0.0000 0.000 vdw h h 0.00..."
18:1318:13, 29 July 2013 diff hist −52 Talk:Mod:Hunt Research Group/QMMM SP Aqeuous Cu(II) No edit summary
18:0718:07, 29 July 2013 diff hist +460 Talk:Mod:Hunt Research Group/QMMM SP Aqeuous Cu(II) No edit summary
17:4617:46, 29 July 2013 diff hist −9 Talk:Mod:Hunt Research Group/QMMM SP Aqeuous Cu(II) No edit summary
16:3516:35, 29 July 2013 diff hist +186 Mod:Hunt Research Group →Running QM/MM Simulations in ChemShell
16:3216:32, 29 July 2013 diff hist +68 Talk:Mod:Hunt Research Group/ChemShell System Aqeuous Cu(II) No edit summary

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