Atom modeling for molecular simulations | Lennard-Jones & Coulomb potentials | MD MC
The Computational Chemist
This video talks about how atoms are normally modeled in molecular simulations (molecular dynamics MD, Monte Carlo MC), starting from the many body potential energy till the Lennard-Jones + Coulomb potentials.
This video appeals to who is approaching molecular simulations (molecular dynamics MD, Monte Carlo MC), and more in general computational chemistry and computational biology.
Sources and materials: Allen, Michael Patrick, and Dominic J. Tildesley. Computer Simulation of Liquids. 2nd ed., Oxford University Press, 2017.
Frenkel, Daan, and Berend Smit. "Understanding molecular simulation: From algorithms to applications." Computational sciences series 1 (2002): 1-638.
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