Ardiyan Taruna

2 Questions 5 Answers 0 Followers

Questions related from Ardiyan Taruna

Hello, I want to ask about how to sett concentration of ligand on md simulations?

If i want to sett the mass of ligand like 50 ng/ml. How to do it? Im using gromacs for simulations

13 December 2022 2,787 5 View

Hello expert, I want to ask about how to set concentration of ligand on molecular dynamics dynamics simulations?

For example, I have quercetine as a ligand and cutinase as protein. If i want to carried out md simulations with different concentration of quercetine, how to do that? I want to do md simulations...

28 November 2022 3,362 4 View