Molecular Dynamics (MD) Simulation

Description

Molecular Dynamics (MD) Simulation is a computational technique that models the movement and interactions of atoms and molecules over time. It is used to evaluate the stability, flexibility, and behavior of protein–ligand complexes under simulated biological conditions, providing deeper insights into molecular interactions beyond molecular docking.

100 ns MD Simulation

Includes:

RMSD
RMSF
Rg (Radius of Gyration)
SASA (Solvent Accessible Surface Area)
H-bond analysis

For:

1 compound + 1 target
Cost: ₦170,000 (though the note is a bit unclear here; this may need confirmation)

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