User contributions for Btingle
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23 June 2022
22 June 2022
- 03:3203:32, 22 June 2022 diff hist +176 Category:AWS DOCK No edit summary current
- 03:3003:30, 22 June 2022 diff hist +307 N Category:AWS DOCK Created page with "Protocols for running DOCK software on AWS. Specifically DOCK 3.8 (and others in the DOCK3 family) Despite these protocols being tailored for the DOCK3 family of software, th..."
- 03:2403:24, 22 June 2022 diff hist +23 AWS:Merge and download results No edit summary
- 03:2403:24, 22 June 2022 diff hist +23 AWS:Set up account No edit summary
- 03:2403:24, 22 June 2022 diff hist +23 AWS:Submit docking job No edit summary
- 03:2203:22, 22 June 2022 diff hist +3,011 AWS:Submit docking job No edit summary
- 01:1901:19, 22 June 2022 diff hist +522 m AWS:Submit docking job →Approach 1: AWS CLI
- 01:1101:11, 22 June 2022 diff hist +1,862 AWS:Submit docking job No edit summary
- 00:5000:50, 22 June 2022 diff hist +22 AWS:Submit docking job →Copying data to Amazon S3
- 00:4300:43, 22 June 2022 diff hist +6 AWS:Set up account →Creating your First AWS Environment
- 00:4200:42, 22 June 2022 diff hist +72 AWS:Set up account →Creating your First AWS Environment
- 00:3800:38, 22 June 2022 diff hist +20 AWS:Set up account →Creating your First AWS Environment
- 00:3500:35, 22 June 2022 diff hist +62 AWS:Set up account →Creating your First AWS Environment
- 00:3400:34, 22 June 2022 diff hist +37 AWS:Set up account →Creating your First AWS Environment
- 00:3200:32, 22 June 2022 diff hist +54 AWS:Set up account →Creating your First AWS Environment
- 00:2900:29, 22 June 2022 diff hist +1,064 AWS:Set up account →Advanced Usage/Configuration Usage
- 00:1800:18, 22 June 2022 diff hist +56 AWS:Set up account →Creating your First AWS Environment
- 00:1600:16, 22 June 2022 diff hist +143 AWS:Set up account →Creating your First AWS Environment
- 00:1500:15, 22 June 2022 diff hist +92 N File:S3pricing.png No edit summary current
21 June 2022
- 23:5923:59, 21 June 2022 diff hist +38 AWS:Set up account →Creating your First AWS Environment
- 23:5323:53, 21 June 2022 diff hist +1,055 N AWS:Submit docking job Created page with "=== Prerequisites === * You've followed the tutorial for setting up the environment: AWS DOCK Environment Setup * Following from the previous requirement, you have the a..."
- 23:0723:07, 21 June 2022 diff hist +4 N File:Aws docking env.png No edit summary current
18 June 2022
- 00:3300:33, 18 June 2022 diff hist +79 AWS:Merge and download results →Step 1: Create an EC2 instance
- 00:1900:19, 18 June 2022 diff hist +248 AWS:Merge and download results →Step 4: Run Analysis and save results
- 00:1900:19, 18 June 2022 diff hist +4 N File:Terminateinstance.png No edit summary current
- 00:1600:16, 18 June 2022 diff hist +273 AWS:Merge and download results →Step 1: Create an EC2 instance
- 00:1600:16, 18 June 2022 diff hist +4 N File:Instancelaunched3.png No edit summary current
- 00:1600:16, 18 June 2022 diff hist +4 N File:Instancelaunched2.png No edit summary current
- 00:1600:16, 18 June 2022 diff hist +4 N File:Instancelaunched1.png No edit summary current
- 00:1500:15, 18 June 2022 diff hist +4 N File:Configstorage.png No edit summary current
- 00:1500:15, 18 June 2022 diff hist +4 N File:Keypair.png No edit summary current
- 00:1300:13, 18 June 2022 diff hist +4 N File:Instancetype.png No edit summary current
- 00:1300:13, 18 June 2022 diff hist +15 N File:Launchinstances.png No edit summary current
- 00:1200:12, 18 June 2022 diff hist +2,519 AWS:Merge and download results No edit summary
17 June 2022
- 23:4223:42, 17 June 2022 diff hist +1,868 N AWS:Merge and download results Created page with "=== Prerequisites === github personal access token & DOCK repository access rights (https://docs.github.com/en/authentication/keeping-your-account-and-data-secure/creating-a-..."
13 June 2022
- 23:5823:58, 13 June 2022 diff hist −8 Search zinc22.py →comb_legacy_files.py
- 23:5323:53, 13 June 2022 diff hist +236 Search zinc22.py →comb_legacy_files.py
- 23:1823:18, 13 June 2022 diff hist +141 OCI Slurm Autoscaling No edit summary
- 23:1623:16, 13 June 2022 diff hist +2,824 N OCI Slurm Autoscaling Created page with "* Create a compartment for your autoscaling resources <nowiki> SlurmAutoScaling</nowiki> * Create a dynamic group for autoscaling instances. Add the following as a matching..."
10 June 2022
- 23:1423:14, 10 June 2022 diff hist −12 Search zinc22.py No edit summary
- 23:1323:13, 10 June 2022 diff hist +1 Search zinc22.py →Location
- 23:1323:13, 10 June 2022 diff hist +3 Search zinc22.py →Location
- 23:1323:13, 10 June 2022 diff hist +258 Search zinc22.py No edit summary
- 22:5722:57, 10 June 2022 diff hist +6 Search zinc22.py →Description
- 22:5722:57, 10 June 2022 diff hist +129 Search zinc22.py →Location
- 22:5522:55, 10 June 2022 diff hist +64 Search zinc22.py →Location
- 22:4622:46, 10 June 2022 diff hist +17 Search zinc22.py →comb_legacy_files.py
- 22:4522:45, 10 June 2022 diff hist +142 Search zinc22.py →comb_legacy_files.py
- 22:4422:44, 10 June 2022 diff hist +9 Search zinc22.py →Dealing with NULL
- 22:4322:43, 10 June 2022 diff hist +145 Search zinc22.py No edit summary
- 22:4122:41, 10 June 2022 diff hist −87 Search zinc22.py →comb_legacy_files.py
- 22:4122:41, 10 June 2022 diff hist +765 Search zinc22.py No edit summary
- 00:5900:59, 10 June 2022 diff hist +22 Search zinc22.py No edit summary
- 00:5900:59, 10 June 2022 diff hist +112 Search zinc22.py No edit summary
9 June 2022
- 09:1409:14, 9 June 2022 diff hist −63 Search zinc22.py →Dealing with NULL
- 09:1209:12, 9 June 2022 diff hist +4 Search zinc22.py →Dealing with NULL
- 09:1209:12, 9 June 2022 diff hist +36 Search zinc22.py →Dealing with NULL
- 09:1109:11, 9 June 2022 diff hist +165 Search zinc22.py →Dealing with NULL
- 09:1009:10, 9 June 2022 diff hist +4 Search zinc22.py →Dealing with NULL
- 09:1009:10, 9 June 2022 diff hist −86 Search zinc22.py →Dealing with NULL
- 09:1009:10, 9 June 2022 diff hist −2 Search zinc22.py →Dealing with NULL
- 09:0909:09, 9 June 2022 diff hist 0 Search zinc22.py →Dealing with NULL
- 09:0909:09, 9 June 2022 diff hist +79 Search zinc22.py →Dealing with NULL
- 09:0809:08, 9 June 2022 diff hist +1,359 Search zinc22.py No edit summary
- 07:2107:21, 9 June 2022 diff hist +214 Search zinc22.py No edit summary
- 07:2007:20, 9 June 2022 diff hist −2 Search zinc22.py →Usage w/ Bash on BKS cluster
- 07:1907:19, 9 June 2022 diff hist −9 Search zinc22.py No edit summary
- 07:1807:18, 9 June 2022 diff hist +252 Search zinc22.py No edit summary
- 07:1507:15, 9 June 2022 diff hist −2 Search zinc22.py No edit summary
- 07:1207:12, 9 June 2022 diff hist −4 Search zinc22.py No edit summary
- 07:0107:01, 9 June 2022 diff hist −7 Search zinc22.py No edit summary
- 06:1906:19, 9 June 2022 diff hist −158 Search zinc22.py No edit summary
- 06:1806:18, 9 June 2022 diff hist +295 Search zinc22.py No edit summary
8 June 2022
- 21:5121:51, 8 June 2022 diff hist +322 Search zinc22.py No edit summary
- 21:4821:48, 8 June 2022 diff hist +105 Search zinc22.py No edit summary
- 21:4821:48, 8 June 2022 diff hist +899 N Search zinc22.py Created page with " <nowiki> usage: search_zinc22.py [-h] [--configuration-server-url CONFIGURATION_SERVER_URL] zinc_id_in results_out positional..."
19 May 2022
- 22:3522:35, 19 May 2022 diff hist −177 How to compile DOCK No edit summary
- 22:3422:34, 19 May 2022 diff hist +168 How to compile DOCK No edit summary
- 21:4021:40, 19 May 2022 diff hist +1,040 N Legacy IDs in ZINC22 Created page with "ZINC22 is by far the largest chemical database this lab has built, and with it's fantastic size we have found fantastic new difficulties. When we receive chemical libraries f..."
- 20:2620:26, 19 May 2022 diff hist +132 How to compile DOCK →compiling dock3.8
- 20:2220:22, 19 May 2022 diff hist +342 How to compile DOCK No edit summary
29 April 2022
- 01:5401:54, 29 April 2022 diff hist −7 How to compile DOCK →compiling dock3.8
- 01:5301:53, 29 April 2022 diff hist +245 How to compile DOCK →gfortran instructions
- 01:5201:52, 29 April 2022 diff hist +1,789 How to compile DOCK No edit summary
22 April 2022
- 21:0321:03, 22 April 2022 diff hist +139 AWS:Set up account No edit summary
- 20:3620:36, 22 April 2022 diff hist +117 AWS:Set up account →Creating your First AWS Environment
22 March 2022
- 20:4720:47, 22 March 2022 diff hist −120 How to dock in DOCK3.8 →DOCKFILES
- 20:3020:30, 22 March 2022 diff hist +6 How to dock in DOCK3.8 →Examples
- 17:5017:50, 22 March 2022 diff hist +137 How to dock in DOCK3.8 →Note on using SHRTCACHE and LONGCACHE
- 17:4517:45, 22 March 2022 diff hist +10 How to dock in DOCK3.8 →Note on using SHRTCACHE and LONGCACHE
- 17:4217:42, 22 March 2022 diff hist +1,351 How to dock in DOCK3.8 No edit summary
18 March 2022
- 07:4507:45, 18 March 2022 diff hist +50 AWS:Set up account →Creating your First AWS Environment
- 04:2304:23, 18 March 2022 diff hist +12 AWS:Set up account →Creating your First AWS Environment
- 04:2304:23, 18 March 2022 diff hist +4 AWS:Set up account →Creating your First Environment
- 04:2304:23, 18 March 2022 diff hist +12 AWS:Set up account →Running the Scripts
- 04:2104:21, 18 March 2022 diff hist +215 AWS:Set up account →Advanced Usage/Configuration Usage
- 04:1604:16, 18 March 2022 diff hist +71 AWS:Set up account →Container Environment
- 04:1504:15, 18 March 2022 diff hist +23 AWS:Set up account →Container Environment
- 04:1404:14, 18 March 2022 diff hist +265 AWS:Set up account →Container Environment