Prateek Kumar

2 Questions 6 Answers 0 Followers

Questions related from Prateek Kumar

Can I perform Principal component analysis (PCA) in gromacs using Desmond trajectories? If yes then how?

Hi all, I have performed simulation with Desmond and now I want to analyze its trajectory based on its principal components. Desmond can not perform this as I got to know. I have converted the...

06 June 2019 8,740 6 View

How to check the blood brain barrier predicted values for peptide molecules?

Chemical compounds and biological compounds have different BBB values? Is there any way to predict BBB values for peptides.

10 October 2018 5,223 3 View