All content
Search filter terms
Filter by category
Filter by type
Filter by tag
Filter by user
Filter by licence
Results per page:
Sort by:
Showing 2 results.
Use the filters on the left and the
search box below to refine the results.
Creator
Natural product likeness filter
Created: 2011-05-13 19:35:39 | Last updated: 2011-08-29 14:25:47
Reference:
Natural Product-likeness Score and Its Application for Prioritization of Compound
Libraries
Peter Ertl,* Silvio Roggo, and Ansgar Schuffenhauer
Novartis Institutes for BioMedical Research, CH-4002 Basel, Switzerland
http://peter-ertl.com/reprints/Ertl-JCIM-48-68-2008.pdf
The natural product likeness scorer implemented by Peter Ertl was originally devised to screen large compound libraries for natural product likeness in drug designing studies. His work...
3 items in this pack
Comments: 0 | Viewed: 190 times | Downloaded: 90 times
Tags:
Plotting distribution of natural product l... (1)
Prerequisite:
CDK -Taverna Plugin 0.5.1
http://www.ts-concepts.de/cdk-taverna2/plugin/
- To run this workflow you need a Score file which is written to text file.
- This could be generated from ScorerActivity.t2flow
http://www.myexperiment.org/workflows/2121/download?version=1
Description of input ports :
score_file: Path to file name that has pre computed scores.
Note:
While passing file as input it could be passed as list of many files or single fi...
Created: 2011-05-13 | Last updated: 2011-05-13
Credits: Kalai
Results per page:
Sort by: