How to calculate predicted IC50 value of given ligand molecule schrodinger phase software ?

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Akash jakklwad asked 1 year ago

How to calculate predicted IC50 value of given ligand molecule schrodinger phase software ?

1 Answers
Prajwal_Schrodinger answered 1 year ago

Yes, the IC50 values of compounds can be predicted using Phase 3D-QSAR module of Schrodinger. You can refer the paper pdfs.semanticscholar.org/a0e8/ca1395f142a66fbdc84b10978e576ac951e3.pdf . 
Also, You can follow the tutorial at youtu.be/2MYXqx0IWVA .
Thanks and best regards

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