Waseem Ahmad Ansari

3 Questions 151 Answers 0 Followers

Questions related from Waseem Ahmad Ansari

What is the main factor involve in higher binding score performing molecular docking?

A molecule shows the -11.6 kcal/mol and second one -8.0 kcal/mol so why molecule (A) revealed higher binding score. Please explain major factor involve in it.

22 July 2024 922 5 View

Can oxygen atom in ligand increase the binding energy?

If a compound has a lot of oxygen moities in ligand, so the docking score will be increase? If it will increase then what is the reason behind it?

17 February 2024 2,119 4 View

How to validate 3D-QSAR hypothesis without experimental IC50 values?

Hello Researchers I'm beginner in 3D-QSAR please enlighten about how to evaluate the 3D-QSAR model. I've read many articles in which mentioned experimental IC50 values then validated. If have no...

27 December 2023 173 2 View