Elaine Joy Torre

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Questions related from Elaine Joy Torre

[CDOCKER protocol and Calculating Binding Energies in Discovery Studio] posssible for a complex to have lower binding energy but weaker interactions?

I'm comparing my top1 ligand in docking and my reference ligand. My reference ligand has more strong interactions than my top1 ligand but my reference ligand has a less negative binding energy...

09 May 2022 1,201 2 View

PGP substrate in SwissADME- Yes or No?

I'm doing ADMET analysis in SwissADME and I have a problem understanding and identifying what should be the ideal classification: if a drug should be a P-glycoprotein substrate or not. Can you...

07 May 2022 1,882 0 View