This is a 5 minutes introduction to molecular dynamics simulation. Tools to generate initial state for your system: – LAMMPS lattice command: This command creates a 2D or 3D lattice. It supports a number of lattice types.
Related Articles
Basics of Molecular Dynamics Simulations
Posted on Author SCOTTxRT
Introduce the basics of the molecular dynamics method to simulate the dynamics of the atoms according to time. Relevant research […]
Mecanica y dinamica molecular clasica
Posted on Author SCOTTxRT
La dinámica molecular (DM) es una técnica de simulación por computadora en la que se permite que átomos y […]
LigandScout mapas de interacción.
Posted on Author SCOTTxRT
Farmacoforos, y residuos con mayor participación . obtencion del mapa de interaccion