User contributions for Btingle
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11 July 2023
- 19:0519:05, 11 July 2023 diff hist +24 All About DB2 Files No edit summary current
14 June 2023
- 00:3300:33, 14 June 2023 diff hist +2 All About DB2 Files →What is the deal with sets and confs?
- 00:3200:32, 14 June 2023 diff hist +19 All About DB2 Files →The nittier grittier
- 00:3100:31, 14 June 2023 diff hist +95 All About DB2 Files →What is the deal with sets and confs?
- 00:2800:28, 14 June 2023 diff hist +19 All About DB2 Files →The nitty gritty
- 00:2600:26, 14 June 2023 diff hist +118 All About DB2 Files →What is the deal with sets and confs?
- 00:2500:25, 14 June 2023 diff hist +171 All About DB2 Files No edit summary
- 00:2000:20, 14 June 2023 diff hist −91 All About DB2 Files No edit summary Tag: Manual revert
- 00:1900:19, 14 June 2023 diff hist +91 All About DB2 Files No edit summary
- 00:1500:15, 14 June 2023 diff hist +2 All About DB2 Files →What is the deal with sets and confs?
- 00:1400:14, 14 June 2023 diff hist +2 All About DB2 Files →The nitty gritty
- 00:1400:14, 14 June 2023 diff hist +2 All About DB2 Files →The brass tacks
- 00:1300:13, 14 June 2023 diff hist +6 All About DB2 Files →The nitty gritty
- 00:1300:13, 14 June 2023 diff hist +4,729 N All About DB2 Files Created page with "== The brass tacks == DB2 files encode & compress 3D molecule rotomers, sometimes referred to as conformations. DB2 files do not store the dihedral angles of rotomers, but instead the per-atom coordinates resulting from those angles Atoms of different rotomers whose coordinates overlap are merged together in db2 files (how this is done will be detailed more later), thus allowing DOCK to avoid double-calculating per-atom energies == The nitty gritty == DB2 is a text fo..."
13 June 2023
- 19:2719:27, 13 June 2023 diff hist +114 Smallworld and Arthor Databases →Smallworld slides/presentations current
- 19:2419:24, 13 June 2023 diff hist +6 Smallworld and Arthor Databases →Smallworld Databases
- 19:2319:23, 13 June 2023 diff hist +157 Smallworld and Arthor Databases No edit summary
- 19:2019:20, 13 June 2023 diff hist +171 Smallworld and Arthor Databases No edit summary
31 May 2023
- 22:2122:21, 31 May 2023 diff hist +91 Installing The 3D Pipeline ZINC22 No edit summary
- 22:2122:21, 31 May 2023 diff hist +2,380 N Installing The 3D Pipeline ZINC22 Created page with "Installation of the 3D pipeline is somewhat tricky- the environment is very particular about which versions of which software should be used. It is thus easiest to copy the exact software packages we use from our servers- this should work provided they are installed in a 64-bit linux architecture, though depending on the distribution certain shared libraries may be missing. == Setting up the installation root == First find a suitable directory which will serve as the r..."
18 May 2023
- 18:5718:57, 18 May 2023 diff hist +85 TLDR →Making changes to modules & scripts
- 18:5618:56, 18 May 2023 diff hist +119 TLDR →Making changes to modules & scripts
- 18:5518:55, 18 May 2023 diff hist +8 TLDR →How to open source code & make a change
- 18:5518:55, 18 May 2023 diff hist −12 TLDR →Technical info
- 18:5418:54, 18 May 2023 diff hist +1,752 TLDR No edit summary
11 May 2023
- 21:3821:38, 11 May 2023 diff hist +23 SUBDOCK DOCK3.8 →What's New?
- 21:3821:38, 11 May 2023 diff hist +238 SUBDOCK DOCK3.8 →What's New?
- 18:1718:17, 11 May 2023 diff hist −59 SUBDOCK DOCK3.8 →What's New?
- 17:5417:54, 11 May 2023 diff hist −1 SUBDOCK DOCK3.8 →Supported Platforms
- 17:5217:52, 11 May 2023 diff hist +42 SUBDOCK DOCK3.8 →Using Charity Engine
- 17:5117:51, 11 May 2023 diff hist +316 SUBDOCK DOCK3.8 →Supported Platforms
- 17:4917:49, 11 May 2023 diff hist +17 SUBDOCK DOCK3.8 →What's New?
- 17:4717:47, 11 May 2023 diff hist +244 SUBDOCK DOCK3.8 →What's New?
- 17:3617:36, 11 May 2023 diff hist +4 SUBDOCK DOCK3.8 →Supported Platforms
- 17:3517:35, 11 May 2023 diff hist +12 SUBDOCK DOCK3.8 →Supported Platforms
- 17:3517:35, 11 May 2023 diff hist 0 SUBDOCK DOCK3.8 →Supported Platforms
- 17:3417:34, 11 May 2023 diff hist +77 SUBDOCK DOCK3.8 →Supported Platforms
25 April 2023
- 21:2121:21, 25 April 2023 diff hist +130 m SUBDOCK DOCK3.8 →Mixing DOCK 3.7 and DOCK 3.8 - known problems
- 20:5820:58, 25 April 2023 diff hist −193 SUBDOCK DOCK3.8 No edit summary
- 20:5420:54, 25 April 2023 diff hist +456 SUBDOCK DOCK3.8 →Error Messages in my OUTDOCK!
- 20:4920:49, 25 April 2023 diff hist +38 SUBDOCK DOCK3.8 →Restartability
- 19:3019:30, 25 April 2023 diff hist +56 m SUBDOCK DOCK3.8 →Full Example - All Steps
21 April 2023
- 23:5923:59, 21 April 2023 diff hist +174 SUBDOCK DOCK3.8 No edit summary
- 20:3420:34, 21 April 2023 diff hist +41 SUBDOCK DOCK3.8 →What's New?
- 20:3120:31, 21 April 2023 diff hist +85 SUBDOCK DOCK3.8 →How to continue jobs
- 20:2920:29, 21 April 2023 diff hist +4 m SUBDOCK DOCK3.8 →How to continue jobs
- 20:2820:28, 21 April 2023 diff hist +178 SUBDOCK DOCK3.8 →How to continue jobs
- 20:2520:25, 21 April 2023 diff hist +1 m SUBDOCK DOCK3.8 →How to use for your Job Platform
- 20:2520:25, 21 April 2023 diff hist +402 SUBDOCK DOCK3.8 →Restartability
- 20:1620:16, 21 April 2023 diff hist +3 m SUBDOCK DOCK3.8 →Restartability
- 20:1520:15, 21 April 2023 diff hist +1 SUBDOCK DOCK3.8 →Restartability
- 20:1520:15, 21 April 2023 diff hist +1 SUBDOCK DOCK3.8 →Restartability
- 20:1520:15, 21 April 2023 diff hist +1,217 SUBDOCK DOCK3.8 No edit summary
- 20:0120:01, 21 April 2023 diff hist +149 SUBDOCK DOCK3.8 →What's New?
- 19:5719:57, 21 April 2023 diff hist +18 SUBDOCK DOCK3.8 →Full Example - All Steps
- 19:5519:55, 21 April 2023 diff hist +1,051 SUBDOCK DOCK3.8 →SUBDOCK help splash - all argument descriptions & defaults
8 April 2023
- 17:0617:06, 8 April 2023 diff hist +50 DOCK 3.8 No edit summary current
- 17:0517:05, 8 April 2023 diff hist −17 How to compile DOCK →PGF License Error & Other Scruples current
- 17:0517:05, 8 April 2023 diff hist +65 How to compile DOCK →compiling dock3.8
27 March 2023
- 22:0222:02, 27 March 2023 diff hist +22 Repackaging DB2 DOCK38 No edit summary current
- 21:5921:59, 27 March 2023 diff hist +439 Repackaging DB2 DOCK38 No edit summary
22 March 2023
- 19:5519:55, 22 March 2023 diff hist +152 OCI:Create account →policies
- 19:5419:54, 22 March 2023 diff hist +1,216 OCI:Create account No edit summary
16 March 2023
- 18:1118:11, 16 March 2023 diff hist +302 Repackaging DB2 DOCK38 No edit summary
- 18:0518:05, 16 March 2023 diff hist +213 Repackaging DB2 DOCK38 No edit summary
9 March 2023
- 18:1118:11, 9 March 2023 diff hist +272 Building The 3D Pipeline ZINC22 →Software Options current
- 18:0718:07, 9 March 2023 diff hist +47 ZINC22:Building 3D Redirected page to Building The 3D Pipeline ZINC22 current Tag: New redirect
- 18:0618:06, 9 March 2023 diff hist 0 ZINC-22:3D Building Changed redirect target from Building the 3D Pipeline ZINC22 to Building The 3D Pipeline ZINC22 current Tag: Redirect target changed
- 18:0618:06, 9 March 2023 diff hist +3 ZINC-22:3D Building Redirected page to Building the 3D Pipeline ZINC22 Tag: New redirect
- 18:0518:05, 9 March 2023 diff hist −2,188 ZINC-22:3D Building Replaced content with "#REDIRECT[Building the 3D Pipeline ZINC22]" Tag: Replaced
7 March 2023
- 20:5720:57, 7 March 2023 diff hist −421 SUBDOCK DOCK3.8 →SUBDOCK help splash - all argument descriptions & defaults
3 March 2023
- 04:5204:52, 3 March 2023 diff hist −36 How to install DOCK 3.8 →Compiling from source current
- 04:5104:51, 3 March 2023 diff hist +395 How to install DOCK 3.8 No edit summary
- 04:4604:46, 3 March 2023 diff hist +132 How to install DOCK 3.8 →Prebuilt Executable
- 04:4404:44, 3 March 2023 diff hist +7 How to install DOCK 3.8 →Prebuilt Executable
- 04:3404:34, 3 March 2023 diff hist +94 Docking Analysis in DOCK3.8 →Usage current
- 04:3404:34, 3 March 2023 diff hist +232 Docking Analysis in DOCK3.8 →Usage
2 March 2023
- 21:4521:45, 2 March 2023 diff hist +22 Building The 3D Pipeline ZINC22 No edit summary
- 21:4121:41, 2 March 2023 diff hist +58 DOCK 3.8 No edit summary
- 21:4021:40, 2 March 2023 diff hist +294 DOCK 3.8 No edit summary
- 21:3421:34, 2 March 2023 diff hist +23 SUBDOCK DOCK3.8 No edit summary
- 21:3321:33, 2 March 2023 diff hist +1 Repackaging DB2 DOCK38 No edit summary
- 21:3321:33, 2 March 2023 diff hist +22 Repackaging DB2 DOCK38 No edit summary
- 21:3221:32, 2 March 2023 diff hist +22 DOCK 3.8 No edit summary
- 21:3021:30, 2 March 2023 diff hist +21 Docking Analysis in DOCK3.8 →Conda Environment
- 21:3021:30, 2 March 2023 diff hist −114 Docking Analysis in DOCK3.8 →Location of new scripts/Install Instructions
- 21:2621:26, 2 March 2023 diff hist 0 SUBDOCK DOCK3.8 No edit summary
- 21:2521:25, 2 March 2023 diff hist +543 SUBDOCK DOCK3.8 No edit summary
- 21:1821:18, 2 March 2023 diff hist +3 Docking Analysis in DOCK3.8 →Location of new scripts/Install Instructions
- 21:0721:07, 2 March 2023 diff hist +2 Docking Analysis in DOCK3.8 →Conda Environment
- 21:0221:02, 2 March 2023 diff hist −313 Docking Analysis in DOCK3.8 →Manual Install
- 21:0221:02, 2 March 2023 diff hist −2,105 Docking Analysis in DOCK3.8 →Python 3.8+
- 20:5920:59, 2 March 2023 diff hist −4 Docking Analysis in DOCK3.8 No edit summary
- 20:5920:59, 2 March 2023 diff hist +204 Docking Analysis in DOCK3.8 →Python 3.8
- 20:5520:55, 2 March 2023 diff hist +26 How to install DOCK 3.8 No edit summary
- 20:5420:54, 2 March 2023 diff hist +207 How to install DOCK 3.8 No edit summary
- 20:4020:40, 2 March 2023 diff hist +24 Main Page No edit summary
- 20:3720:37, 2 March 2023 diff hist +11 DOCK 3.8 No edit summary
- 20:3420:34, 2 March 2023 diff hist −2 Building The 3D Pipeline ZINC22 No edit summary
- 20:3320:33, 2 March 2023 diff hist +387 Building The 3D Pipeline ZINC22 No edit summary
- 20:3120:31, 2 March 2023 diff hist +297 Repackaging DB2 DOCK38 No edit summary
- 20:2920:29, 2 March 2023 diff hist +1,364 N Repackaging DB2 DOCK38 Created page with "The following is a script for repackaging 3D pipeline results. First, here is the script: <nowiki> #!/bin/bash # make_tarballs.bash # required parameter RESULT_DIRECTORY=$1 # optional parameters WORKING_DIRECTORY=${WORKING_DIRECTORY-/tmp/$(whoami)} PACKAGES_PER_PACKAGE=${PACKAGES_PER_PACKAGE-100} PACKAGE_TYPE=${PACKAGE_TYPE-db2.gz} PACKAGE_TYPE_SHORT=$(echo $PACKAGE_TYPE | cut -d'.' -f1) echo WORKING_DIRECTORY=$WORKING_DIRECTORY mkdir -p $WORKING_DIRECTORY && cd $WO..."
28 February 2023
- 18:5418:54, 28 February 2023 diff hist +349 SUBDOCK DOCK3.8 No edit summary
- 18:4718:47, 28 February 2023 diff hist +121 DOCK 3.8 No edit summary
- 18:4318:43, 28 February 2023 diff hist +1 DOCK 3.8 No edit summary
- 18:4318:43, 28 February 2023 diff hist +137 DOCK 3.8 No edit summary
10 February 2023
- 00:0400:04, 10 February 2023 diff hist +309 Building The 3D Pipeline ZINC22 →Job Submission Arguments
9 February 2023
- 23:5323:53, 9 February 2023 diff hist −8 Building The 3D Pipeline ZINC22 →Examples
- 23:5023:50, 9 February 2023 diff hist +146 Building The 3D Pipeline ZINC22 →Examples
- 23:4523:45, 9 February 2023 diff hist +55 Building The 3D Pipeline ZINC22 →Job Submission Arguments
- 23:4223:42, 9 February 2023 diff hist +15 Building The 3D Pipeline ZINC22 →OMEGA_RMSD
- 23:4223:42, 9 February 2023 diff hist +157 Building The 3D Pipeline ZINC22 →Omega Arguments
- 23:4123:41, 9 February 2023 diff hist +529 Building The 3D Pipeline ZINC22 No edit summary
6 February 2023
- 22:2122:21, 6 February 2023 diff hist −42 SUBDOCK DOCK3.8 →full example - all steps
- 22:1922:19, 6 February 2023 diff hist −24 SUBDOCK DOCK3.8 →installing
- 22:1922:19, 6 February 2023 diff hist +91 SUBDOCK DOCK3.8 No edit summary
1 February 2023
- 18:1618:16, 1 February 2023 diff hist +3 SUBDOCK DOCK3.8 No edit summary
2 December 2022
- 23:1423:14, 2 December 2022 diff hist −38 m SUBDOCK DOCK3.8 →full example - all steps
- 23:1323:13, 2 December 2022 diff hist −302 SUBDOCK DOCK3.8 No edit summary
- 04:5804:58, 2 December 2022 diff hist −1 m SUBDOCK DOCK3.8 →full example - all steps
- 01:5201:52, 2 December 2022 diff hist +672 SUBDOCK DOCK3.8 No edit summary
1 December 2022
- 23:5223:52, 1 December 2022 diff hist +194 SUBDOCK DOCK3.8 No edit summary
- 23:4623:46, 1 December 2022 diff hist +162 SUBDOCK DOCK3.8 →what's new?
- 22:3022:30, 1 December 2022 diff hist +82 DOCK 3.8 No edit summary
- 22:2822:28, 1 December 2022 diff hist +114 How to dock in DOCK3.8 No edit summary current
- 22:2222:22, 1 December 2022 diff hist +135 SUBDOCK DOCK3.8 →full example - all steps
- 22:2022:20, 1 December 2022 diff hist −443 SUBDOCK DOCK3.8 No edit summary
- 21:4921:49, 1 December 2022 diff hist +61 SUBDOCK DOCK3.8 →full example - all steps
- 21:4821:48, 1 December 2022 diff hist −428 SUBDOCK DOCK3.8 No edit summary
- 21:4721:47, 1 December 2022 diff hist +2,215 SUBDOCK DOCK3.8 No edit summary
- 02:1502:15, 1 December 2022 diff hist +295 SUBDOCK DOCK3.8 No edit summary
- 02:1402:14, 1 December 2022 diff hist +4,590 N SUBDOCK DOCK3.8 Created page with "== how to use subdock == Subdock is a utility for running UCSF docking workloads across multiple platforms. There are four essential ingredients that go in to every docking..."
27 October 2022
- 17:3117:31, 27 October 2022 diff hist −164 Building The 3D Pipeline ZINC22 No edit summary
- 17:2917:29, 27 October 2022 diff hist −404 Building The 3D Pipeline ZINC22 No edit summary
19 October 2022
- 20:3820:38, 19 October 2022 diff hist −2 AWS:Set up account →Installation current
- 20:3820:38, 19 October 2022 diff hist +8 N File:Step1-docktut-again.png No edit summary current
- 20:3620:36, 19 October 2022 diff hist −85 AWS:Set up account →Environment Creation
- 20:3520:35, 19 October 2022 diff hist −115 AWS:Set up account →Environment Creation
- 20:3320:33, 19 October 2022 diff hist +4 N File:Stepwhatever2.png No edit summary current
- 20:3320:33, 19 October 2022 diff hist +4 N File:Stepwhatever.png No edit summary current
- 20:2520:25, 19 October 2022 diff hist +13 N File:Step6.png No edit summary current
- 20:2220:22, 19 October 2022 diff hist +182 AWS:Set up account →S3 Bucket
- 20:2120:21, 19 October 2022 diff hist +132 N File:Awsdock-Step3-flowchart.png No edit summary current
- 20:1520:15, 19 October 2022 diff hist +64 N File:Step3.png No edit summary current
- 20:1220:12, 19 October 2022 diff hist −483 AWS:Set up account →Installation
- 20:1220:12, 19 October 2022 diff hist +68 N File:Awsdock-imagetut-step1.png No edit summary current
18 October 2022
- 19:3019:30, 18 October 2022 diff hist +7 Add Tools18 module No edit summary current
11 October 2022
- 22:1122:11, 11 October 2022 diff hist +3 AWS:Submit docking job →auto aws configure current
- 22:1022:10, 11 October 2022 diff hist +3 AWS:Upload files for docking →Approach 2: AWS CLI current
- 22:1022:10, 11 October 2022 diff hist +15 AWS:Set up account No edit summary
24 August 2022
- 18:5718:57, 24 August 2022 diff hist −22 Building The 3D Pipeline ZINC22 No edit summary
- 18:5318:53, 24 August 2022 diff hist +4 Building The 3D Pipeline ZINC22 No edit summary
15 August 2022
- 23:0723:07, 15 August 2022 diff hist −20 Building The 3D Pipeline ZINC22 →Examples
- 23:0323:03, 15 August 2022 diff hist +15 Building The 3D Pipeline ZINC22 →Examples
- 23:0323:03, 15 August 2022 diff hist +10 Building The 3D Pipeline ZINC22 →Script Arguments
- 22:5522:55, 15 August 2022 diff hist +17 Building The 3D Pipeline ZINC22 →Wynton Cluster Installation
- 22:5422:54, 15 August 2022 diff hist −323 Building The 3D Pipeline ZINC22 →Wynton Cluster Installation
- 22:5022:50, 15 August 2022 diff hist −200 Building The 3D Pipeline ZINC22 →Introduction
- 22:5022:50, 15 August 2022 diff hist −67 Building The 3D Pipeline ZINC22 →License Requirements
- 22:3922:39, 15 August 2022 diff hist +30 Building The 3D Pipeline ZINC22 →Script Arguments
- 22:3922:39, 15 August 2022 diff hist +352 Building The 3D Pipeline ZINC22 →Script Arguments
- 22:2922:29, 15 August 2022 diff hist +33 Building The 3D Pipeline ZINC22 →Step 2: Download Submission Scripts
- 22:2822:28, 15 August 2022 diff hist +3 Building The 3D Pipeline ZINC22 →Optional Arguments
- 22:2622:26, 15 August 2022 diff hist +44 Building The 3D Pipeline ZINC22 →Examples
- 22:2422:24, 15 August 2022 diff hist −31 Building The 3D Pipeline ZINC22 No edit summary
- 22:2422:24, 15 August 2022 diff hist −70 Building The 3D Pipeline ZINC22 →Requirements
- 22:2322:23, 15 August 2022 diff hist +92 Building The 3D Pipeline ZINC22 →BKS Cluster Installation
- 22:1722:17, 15 August 2022 diff hist 0 Building The 3D Pipeline ZINC22 No edit summary
- 22:1722:17, 15 August 2022 diff hist +195 Building The 3D Pipeline ZINC22 No edit summary
- 22:1522:15, 15 August 2022 diff hist −2,058 Building The 3D Pipeline ZINC22 No edit summary
8 August 2022
3 August 2022
- 22:4422:44, 3 August 2022 diff hist +2 Docking Analysis in DOCK3.8 →Note on Parallel Processing
- 22:4322:43, 3 August 2022 diff hist +204 AWS:Merge and download results →Step 4: Run Analysis and save results
- 22:4022:40, 3 August 2022 diff hist −26 Using AWS Setup For Cloud Computation →Translating Cluster Concepts to AWS Cloud Concepts
- 22:4022:40, 3 August 2022 diff hist −8 Using AWS Setup For Cloud Computation →Translating Cluster Concepts to AWS Cloud Concepts
- 22:3322:33, 3 August 2022 diff hist +7 Using AWS Setup For Cloud Computation →Introduction to the aws-setup platform
- 21:3421:34, 3 August 2022 diff hist +22 Using AWS Setup For Cloud Computation →Batch Environments in aws-setup
- 21:3321:33, 3 August 2022 diff hist +1,309 Using AWS Setup For Cloud Computation No edit summary
- 20:4820:48, 3 August 2022 diff hist +2,313 N Using AWS Setup For Cloud Computation Created page with "= Introduction to the AWS Setup platform = The concept of "the cloud" as a platform for computation is somewhat mystified. Scientists talk about running their calculations "i..."
2 August 2022
29 July 2022
- 20:2420:24, 29 July 2022 diff hist +147 AWS:Merge and download results No edit summary
28 July 2022
- 19:3719:37, 28 July 2022 diff hist +161 AWS:Merge and download results →Prerequisites
- 19:3219:32, 28 July 2022 diff hist −3 AWS:Submit docking job No edit summary
- 19:2819:28, 28 July 2022 diff hist 0 AWS:Submit docking job →Quickstart- Submitting docking jobs through AWS
- 19:2819:28, 28 July 2022 diff hist +286 AWS:Submit docking job No edit summary
- 19:2219:22, 28 July 2022 diff hist +22 AWS:Submit docking job No edit summary
- 19:0019:00, 28 July 2022 diff hist +54 AWS:Submit docking job →Quick Start
- 18:5818:58, 28 July 2022 diff hist +498 AWS:Submit docking job →Requirements
- 18:4618:46, 28 July 2022 diff hist +29 AWS:Submit docking job →Running supersub.bash
- 18:4618:46, 28 July 2022 diff hist +450 AWS:Submit docking job →Running supersub.bash
- 18:4018:40, 28 July 2022 diff hist +42 AWS:Submit docking job →Approach 2: AWS CLI
- 18:3918:39, 28 July 2022 diff hist +226 AWS:Submit docking job →Approach 2: AWS CLI
- 18:3518:35, 28 July 2022 diff hist +72 AWS:Submit docking job →Approach 2: AWS CLI
- 18:3418:34, 28 July 2022 diff hist +20 AWS:Set up account →Environment Creation
- 18:3318:33, 28 July 2022 diff hist −2 AWS:Set up account →Environment Creation
- 18:3218:32, 28 July 2022 diff hist +154 AWS:Set up account →Environment Creation
- 18:1618:16, 28 July 2022 diff hist +5 AWS:Set up account →Container Environment
- 18:1518:15, 28 July 2022 diff hist +10 AWS:Set up account →Installation
- 18:1218:12, 28 July 2022 diff hist +116 AWS:Set up account →Installation
- 17:5917:59, 28 July 2022 diff hist −14 AWS:Set up account →Bid Percentage
- 17:5117:51, 28 July 2022 diff hist +24 AWS DOCK Environment Setup Advanced Usage No edit summary current
- 17:5117:51, 28 July 2022 diff hist +1,148 AWS DOCK Environment Setup Advanced Usage No edit summary
- 17:3917:39, 28 July 2022 diff hist +1 AWS:Set up account →S3 Bucket
- 17:3817:38, 28 July 2022 diff hist −26 AWS:Set up account →S3 Bucket
- 17:3317:33, 28 July 2022 diff hist +408 AWS:Set up account →Quickstart - Creating your first AWS docking environment
- 16:5416:54, 28 July 2022 diff hist +82 AWS:Set up account →S3 Bucket
- 16:5316:53, 28 July 2022 diff hist +153 AWS:Set up account →Environment Creation
27 July 2022
- 17:0517:05, 27 July 2022 diff hist −3 AWS:Submit docking job →Alternative DOCK Executable
- 17:0517:05, 27 July 2022 diff hist +25 AWS:Submit docking job →Alternative DOCK Executable
- 17:0317:03, 27 July 2022 diff hist +135 AWS:Submit docking job →Copying data to Amazon S3
- 16:5816:58, 27 July 2022 diff hist +1 AWS:Set up account →Installation
- 16:5516:55, 27 July 2022 diff hist +121 AWS:Set up account →Quickstart - Creating your first AWS docking environment
- 16:5416:54, 27 July 2022 diff hist −111 AWS:Set up account →Container Environment
- 16:5316:53, 27 July 2022 diff hist −5,159 AWS:Set up account No edit summary
- 06:0606:06, 27 July 2022 diff hist +5,185 N AWS DOCK Environment Setup Advanced Usage Created page with "= Advanced Usage/Configuration Usage = If you followed the tutorial above, you may have noticed that the create-aws-batch-env.bash script was provided a file, awsdock.config,..."
- 06:0606:06, 27 July 2022 diff hist −329 AWS:Set up account →Quickstart - Creating your first AWS docking environment
- 05:5405:54, 27 July 2022 diff hist −520 AWS:Set up account →Quickstart - Creating your first AWS docking environment
- 05:4405:44, 27 July 2022 diff hist −457 AWS:Set up account →Quickstart - Creating your first AWS docking environment
- 05:3805:38, 27 July 2022 diff hist +2 AWS:Merge and download results No edit summary
- 05:3805:38, 27 July 2022 diff hist −23 AWS:Merge and download results No edit summary
- 05:3805:38, 27 July 2022 diff hist +112 AWS:Merge and download results No edit summary
- 05:3605:36, 27 July 2022 diff hist +136 AWS:Submit docking job No edit summary
- 05:3505:35, 27 July 2022 diff hist +42 AWS:Set up account No edit summary
- 05:0905:09, 27 July 2022 diff hist −180 AWS:Set up account →Creating your First AWS Environment
26 July 2022
- 17:1517:15, 26 July 2022 diff hist +166 AWS:Submit docking job →Monitoring Jobs
- 17:1417:14, 26 July 2022 diff hist −221 AWS:Submit docking job →Running supersub.bash
- 17:1317:13, 26 July 2022 diff hist +221 AWS:Submit docking job →Quick Start
- 17:1117:11, 26 July 2022 diff hist −106 AWS:Submit docking job No edit summary
- 17:1017:10, 26 July 2022 diff hist +244 AWS:Submit docking job →Resource Limits
- 17:0717:07, 26 July 2022 diff hist +1,465 AWS:Submit docking job No edit summary
- 16:5716:57, 26 July 2022 diff hist +11 N File:Spotlimits.png No edit summary current
25 July 2022
- 19:3819:38, 25 July 2022 diff hist +1,141 DOCK memory and CPU benchmark No edit summary current
- 16:5916:59, 25 July 2022 diff hist +850 N DOCK memory and CPU benchmark Created page with "Excerpt from email between Ben Tingle and Jiankun Lyu: <nowiki> JK- I have some more info on how threads/cpus work. It seems that utilizing threads does give more power, but..."
22 July 2022
- 20:4820:48, 22 July 2022 diff hist +139 Zfs →Panic!! The disk is full and I can't remove files!
- 20:4620:46, 22 July 2022 diff hist +71 Zfs →Panic!! The disk is full and I can't remove files!
- 20:4520:45, 22 July 2022 diff hist +1,418 Zfs →Troubleshooting
30 June 2022
- 18:0918:09, 30 June 2022 diff hist +215 Legacy IDs in ZINC22 No edit summary current
29 June 2022
- 19:0719:07, 29 June 2022 diff hist +7 AWS:Set up account →Creating your First AWS Environment
- 19:0619:06, 29 June 2022 diff hist +127 AWS:Set up account →Creating your First AWS Environment
- 19:0319:03, 29 June 2022 diff hist +258 AWS:Submit docking job →Running supersub.bash
- 18:5018:50, 29 June 2022 diff hist +76 AWS:Submit docking job →Monitoring Jobs
- 18:2018:20, 29 June 2022 diff hist +30 AWS:Set up account →Creating your First AWS Environment
27 June 2022
- 19:4319:43, 27 June 2022 diff hist +63 AWS:Set up account →Creating your First AWS Environment
- 19:3819:38, 27 June 2022 diff hist +307 AWS:Submit docking job →Running supersub.bash
- 19:2519:25, 27 June 2022 diff hist +256 AWS:Set up account →Installation
- 19:1819:18, 27 June 2022 diff hist +68 AWS:Submit docking job →Monitoring Jobs
- 19:1519:15, 27 June 2022 diff hist +354 AWS:Submit docking job →Running supersub.bash
24 June 2022
- 00:0500:05, 24 June 2022 diff hist +1,379 AWS:Submit docking job No edit summary
23 June 2022
- 23:3923:39, 23 June 2022 diff hist +759 Docking Analysis in DOCK3.8 →top_poses.py
- 23:3423:34, 23 June 2022 diff hist +47 Docking Analysis in DOCK3.8 No edit summary