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energy-functions

Here are 3 public repositories matching this topic...

torchmd / torchmd-net

Training neural network potentials

molecular-dynamics transformer neural-networks energy-functions equivariant-representations

Updated Aug 16, 2024
Python

vtlim / plot_potential

Plot individual potential functions that comprise force fields. Ideal for presentations. Includes energy terms for bonds (harmonic), angles (harmonic), proper torsion (periodic cosine), improper torsion (harmonic), van der Waals (Lennard-Jones), electrostatics (Coulomb), and the Morse potential.

molecular-dynamics computational-chemistry morse molecular-simulation potential matplotlib coulomb-interactions harmonic cosine presentation-materials forcefield lennard-jones molecular-modeling vdw energy-functions

Updated May 5, 2021
Python

hopfield-network-simulator

Dor-sketch / hopfield-network-simulator

An interactive tool for exploring Hopfield networks, showcasing neural dynamics, pattern recognition, and TSP optimization.

gui ai neural-network hopfield-network tsp-problem hopfield-neural-network energy-functions

Updated Apr 7, 2024
Python

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