Ecosyste.ms: Repos
An open API service providing repository metadata for many open source software ecosystems.
GitHub topics: lennard-jones
comecattin/F-MD
Molecular Dynamic using Fortran
Language: Fortran - Size: 72.3 KB - Last synced: about 20 hours ago - Pushed: about 22 hours ago - Stars: 0 - Forks: 0
LalitPatidar/transpy
Python code to generate Lennard-Jones parameters for combustion and detonation modeling
Language: Python - Size: 99.6 KB - Last synced: 9 days ago - Pushed: over 5 years ago - Stars: 2 - Forks: 1
JuliaMolSim/Molly.jl
Molecular simulation in Julia
Language: Julia - Size: 81.5 MB - Last synced: 2 months ago - Pushed: 2 months ago - Stars: 361 - Forks: 51
Mjboothaus/PhD-Thesis
Reimplementation of the code used in my PhD thesis - Charged fluids near interfaces: Integral equation theory
Language: Jupyter Notebook - Size: 4.52 MB - Last synced: 5 months ago - Pushed: 5 months ago - Stars: 1 - Forks: 2
r-aristov/simba-ps
Fast deterministic all-Python Lennard-Jones particle simulator that utilizes Numba for GPU-accelerated computation.
Language: Python - Size: 84.9 MB - Last synced: 5 months ago - Pushed: 11 months ago - Stars: 65 - Forks: 5
JS-Koning/compphys_project_1
First joint project in Python using Git. Molecular dynamic simulation of Argon atoms.
Language: Python - Size: 80.2 MB - Last synced: 5 months ago - Pushed: 11 months ago - Stars: 1 - Forks: 0
oiao/gbpot
Python implementation of the anisotropic Gay-Berne potential
Language: Python - Size: 4.06 MB - Last synced: 5 months ago - Pushed: almost 4 years ago - Stars: 1 - Forks: 0
frydaddy07/STICS-Portfolio
A portfolio of the work done during COMP 260 during S17 at Wesleyan University
Language: Python - Size: 7.81 KB - Last synced: 8 months ago - Pushed: about 7 years ago - Stars: 1 - Forks: 0
tillsiebenmorgen/RS-REMD_tutorial
This is a tutorial to perform the lennard-jones parameter scaling for rs-remd (repulsive scaling remd) simulations for the amber package.
Language: Python - Size: 321 MB - Last synced: 8 months ago - Pushed: about 3 years ago - Stars: 2 - Forks: 0
vlvovch/lennard-jones-cuda
Molecular dynamics simulation and visualization of the Lennard-Jones system utilizing CUDA-enabled GPU's
Language: C++ - Size: 9.58 MB - Last synced: 8 months ago - Pushed: 8 months ago - Stars: 9 - Forks: 0
locuoco/molecular_dynamics
A 3D interactive program for molecular dynamics
Language: C++ - Size: 18.6 MB - Last synced: 9 months ago - Pushed: 9 months ago - Stars: 5 - Forks: 1
diegonti/MD_Simulation Fork of Eines-Informatiques-Avancades/Project_I
EIA Project for the Computational Modelling Master's Degree.
Language: Fortran - Size: 15.7 MB - Last synced: 6 months ago - Pushed: about 1 year ago - Stars: 0 - Forks: 0
SuldinVyacheslav/Inertia-MolecularDynamics
Light program for researching molecules motion with the ability to build graphs of physical quantities.
Language: CMake - Size: 1.78 MB - Last synced: over 1 year ago - Pushed: over 1 year ago - Stars: 1 - Forks: 0
JMorado/NanoMC
NanoMC is a software that simulates Lennard-Jones fluids inside nanotubes.
Language: Fortran - Size: 2.65 MB - Last synced: over 1 year ago - Pushed: about 3 years ago - Stars: 0 - Forks: 0
Amphiluke/potprox
Approximation of computed data with empirical pair potentials
Language: JavaScript - Size: 890 KB - Last synced: 12 days ago - Pushed: 4 months ago - Stars: 1 - Forks: 0
aromanro/Scattering
Scattering on a Lennard-Jones potential, cross-section computation.
Language: C++ - Size: 83 KB - Last synced: over 1 year ago - Pushed: over 1 year ago - Stars: 7 - Forks: 2
ethashamahmed/molecular-dynamics-LJ
A molecular dynamics project based on the Lennard-Jones potential
Language: Python - Size: 18.6 KB - Last synced: about 1 year ago - Pushed: over 1 year ago - Stars: 0 - Forks: 1
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.
Language: Python - Size: 186 KB - Last synced: 8 months ago - Pushed: about 3 years ago - Stars: 0 - Forks: 0
zhaonat/molecular_dynamics
exploration of MD simulations in MATLAB using the Verlet integrator
Language: Matlab - Size: 485 KB - Last synced: over 1 year ago - Pushed: about 6 years ago - Stars: 2 - Forks: 1
j1nma/time-step-molecular-dynamics
⚛️ Molecular Dynamics Simulation: Lennard-Jones and Damped Harmonic Oscillator
Language: Java - Size: 1.03 MB - Last synced: over 1 year ago - Pushed: almost 5 years ago - Stars: 0 - Forks: 0
