Kavitha T

2 Questions 6 Answers 0 Followers

Questions related from Kavitha T

Can anyone help me to select the protein structure for Docking studies of my molecule under PASS prediction results?

I have a molecule whose PASS predictions are with me. But I cant select the proper protein structure to dock. It has good activity as Cl--transporting ATPase inhibitor. But I don't have literature...

19 August 2016 1,335 3 View

Can anyone help me to draw PDOS spectra and ODOS spectra using Gausssum?

Which file has to be inputted to draw ODOS and PDOS spectra in Gausssum 3? I have given the optimised geometry output for drawing the TDOS spectrum. Is it correct? I am struggling for the next...

30 October 2015 3,085 8 View