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SCREENING FOR A LARGE NUMBER OF MOLECULES FOR LIPINSKI RULE?

PostPosted: Wed Aug 17, 2016 5:29 pm
by praveenkumarpgiindia
Hello PyRx users,

I am interested in screening large number of compund in PyRX ... I want to select only those compund which obey the Lipinski rule???? I want to know how to screen for Lipinski rule for a large number of molecule which are in sdf format???


I know that this option is not available in PyRX ... Please suggest an alternative.....