Alvea Tasneem

2 Questions 4 Answers 0 Followers

Questions related from Alvea Tasneem

What are the tools/software for calculating SASA values of MD simulated water molecules using NAMD?

Hello Everyone. I would like to know about any different tools or softwares (freely available) that can predict the SASA value for MD simulated water molecules using NAMD. I have tried using VMD...

01 January 2020 7,660 5 View

What is the configuration file for blind docking using PyRx for multiple ligands?

I am trying to run blind docking with multiple ligands and one macromolecule using PyRx but somehow i am getting poor binding affinities. What is the configuration file for blind docking in PyRx...

04 April 2019 9,159 4 View