User contributions for Jklyu
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18 September 2017
- 22:1822:18, 18 September 2017 diff hist +880 Large-scale SMILES requesting No edit summary
- 21:5921:59, 18 September 2017 diff hist +20 Large-scale SMILES requesting No edit summary
- 21:5821:58, 18 September 2017 diff hist +156 N Large-scale SMILES requesting Created page with "Written by Jiankun Lyu, 20170918 This tutorial is for requesting a large number of SMILES from ZINC server. Usually, the number is larger than 5M ZINC IDs."
- 21:5421:54, 18 September 2017 diff hist +36 DOCK 3.7 →Post Docking Clustering
- 21:5321:53, 18 September 2017 diff hist +59 N Bemis-Murcko Scaffold Analysis Created page with "= Getting SMILES for ZINC compounds you are interested in ="
- 21:4821:48, 18 September 2017 diff hist +96 DOCK 3.7 No edit summary
13 September 2017
- 20:4120:41, 13 September 2017 diff hist +161 ECFP4 Best First Clustering No edit summary
- 20:3020:30, 13 September 2017 diff hist +435 N ECFP4 Best First Clustering Created page with "Run the script at where your extract_all.sort.uniq.txt locates cd where your extract_all.sort.uniq.txt locates csh ~jklyu/zzz.script/large_scale_docking/cluster_analysis/be..."
- 20:2620:26, 13 September 2017 diff hist +62 DOCK 3.7 No edit summary
- 19:1419:14, 13 September 2017 diff hist +169 Substructure searching No edit summary current
- 19:0119:01, 13 September 2017 diff hist −583 Substructure searching No edit summary
- 18:5818:58, 13 September 2017 diff hist +4 Substructure searching No edit summary
- 18:2618:26, 13 September 2017 diff hist +247 Substructure searching No edit summary
- 18:2118:21, 13 September 2017 diff hist +499 Substructure searching No edit summary
- 18:1218:12, 13 September 2017 diff hist 0 File:Subsearching fig2.png Jklyu uploaded a new version of "File:Subsearching fig2.png" current
- 18:0518:05, 13 September 2017 diff hist 0 N File:Subsearching fig2.png No edit summary
- 18:0518:05, 13 September 2017 diff hist +78 Substructure searching No edit summary
- 18:0318:03, 13 September 2017 diff hist 0 N File:Subsearching fig1.png No edit summary current
- 18:0218:02, 13 September 2017 diff hist +102 Substructure searching No edit summary
- 18:0018:00, 13 September 2017 diff hist +731 Substructure searching No edit summary