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Lipinski's rule [message #975] Mon, 29 June 2020 04:33 Go to previous message
sansun is currently offline  sansun
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Registered: April 2019
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Is there a way to filter/mark compounds that do not comply to 2 or more parameters of the Lipinski's rule of 5 in datawarrior?

Probably it can be done using 'calcualated values'
 
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