Medchem rules [message #1679] |
Sat, 16 July 2022 14:17 |
sansun
Messages: 49 Registered: April 2019
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Hi Thomas
I was wondering if you are planning to add a direct way of implementing various MedChem rules such as rule of 5, Veber's criteria, PAINS, etc.?
Currently, we can do it using 'Calculated Column' but not very efficiently. I understand 'creating macro' is another option. However, I found that as the version change, sometimes column name changes and hence, macros created with the previous versions are sometimes incompatible with the new ones.
Thanks
SS
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