User contributions for Rstein
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11 March 2020
- 01:4901:49, 11 March 2020 diff hist −9 Generating decoys (Reed's way) →Step 3) Assigning decoys to ligands
6 March 2020
- 23:2823:28, 6 March 2020 diff hist +29 Generating decoys (Reed's way) →Step 1) Setting up SMILES directory
- 23:2823:28, 6 March 2020 diff hist +29 Generating decoys (Reed's way) →Step 1) Setting up directories for Protomers
30 October 2019
- 19:3919:39, 30 October 2019 diff hist 0 Converting SMILES to Kekule Format No edit summary current
17 October 2019
- 21:1121:11, 17 October 2019 diff hist +237 Converting SMILES to Kekule Format No edit summary
- 21:0421:04, 17 October 2019 diff hist −8 Converting SMILES to Kekule Format No edit summary
- 21:0421:04, 17 October 2019 diff hist +329 N Converting SMILES to Kekule Format Created page with "For adding molecular structures to slides/papers, SMILEs can be converted into Kekule format with the following command: /nfs/soft/jchem/current/bin/molconvert s..."
- 21:0221:02, 17 October 2019 diff hist +41 DOCK 3.7 →Analysis
11 October 2019
- 00:5700:57, 11 October 2019 diff hist −3 Generating decoys (Reed's way) →Querying ZINC for SMILES
- 00:5600:56, 11 October 2019 diff hist −3 Generating decoys (Reed's way) →Step 1) Setting up directories for Protomers
10 October 2019
- 18:5918:59, 10 October 2019 diff hist +535 Protein Target Preparation Updated →Running Blastermaster current
4 October 2019
- 02:1002:10, 4 October 2019 diff hist +25 Protein Target Preparation Updated →Running Blastermaster
3 October 2019
- 17:3117:31, 3 October 2019 diff hist +105 Protein Target Preparation Updated →Useful References
- 17:2817:28, 3 October 2019 diff hist +11 Protein Target Preparation Updated →Running Blastermaster
- 17:2817:28, 3 October 2019 diff hist +144 Protein Target Preparation Updated →Running Blastermaster
- 17:2617:26, 3 October 2019 diff hist +14 Protein Target Preparation Updated →Running Blastermaster
- 17:2417:24, 3 October 2019 diff hist +6 Protein Target Preparation Updated →Useful References
- 17:2417:24, 3 October 2019 diff hist +1,606 Protein Target Preparation Updated No edit summary
- 17:0917:09, 3 October 2019 diff hist −3 Protein Target Preparation Updated →Running Blastermaster
- 17:0817:08, 3 October 2019 diff hist +274 Protein Target Preparation Updated →Running Blastermaster