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toxicitychecker

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toxicitychecker [2012/12/15 15:11] – created rkisstoxicitychecker [2013/01/13 13:34] flack
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 ====== Toxicity checker ====== ====== Toxicity checker ======
  
 +  * Searching for substructures commonly found in toxic and promiscuous ligands
 +  * Based on more than 100 SMARTS toxic matching rules
 +  * Reject problematic compounds to avoid toxicity, selectivity and pharmacokinetic issues in further development
toxicitychecker.txt · Last modified: 2013/10/11 08:41 by rkiss