User Tools

Site Tools


1clickscaffoldhop

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

Both sides previous revisionPrevious revision
1clickscaffoldhop [2013/12/02 23:39] – smaller screenshot sanmark1clickscaffoldhop [2014/02/26 00:01] (current) flack
Line 53: Line 53:
       * N/O atoms   Min: 1       * N/O atoms   Min: 1
   - [[reos|REOS]]   - [[reos|REOS]]
-  - [[sampler|Sampler]] 
-      * Output: 500,000 compounds (randomized) 
   - [[diversitysel|Diversity selection]]   - [[diversitysel|Diversity selection]]
       * Similarity threshold: 1.0       * Similarity threshold: 1.0
       * Max number of most diverse molecules: 10,000       * Max number of most diverse molecules: 10,000
1clickscaffoldhop.txt · Last modified: 2014/02/26 00:01 by flack