Name		Name	Last commit message	Last commit date
docs		docs
include		include
src		src
test		test
.gitignore		.gitignore
README.md		README.md
compressPacking.cpp		compressPacking.cpp
extendActive.cpp		extendActive.cpp
extendLangevin.cpp		extendLangevin.cpp
jamPacking.cpp		jamPacking.cpp
linearExtendActive.cpp		linearExtendActive.cpp
linearExtendActive2LJ.cpp		linearExtendActive2LJ.cpp
linearExtendNH2LJ.cpp		linearExtendNH2LJ.cpp
linearExtendNVE.cpp		linearExtendNVE.cpp
linearExtendNVE2LJ.cpp		linearExtendNVE2LJ.cpp
linearExtendNVT.cpp		linearExtendNVT.cpp
linearExtendNVT2LJ.cpp		linearExtendNVT2LJ.cpp
linearShearFIRE.cpp		linearShearFIRE.cpp
linearShearNVT.cpp		linearShearNVT.cpp
makefile		makefile
measurePressure.cpp		measurePressure.cpp
measureTemperature.cpp		measureTemperature.cpp
runABP.cpp		runABP.cpp
runActive.cpp		runActive.cpp
runActive2LJ.cpp		runActive2LJ.cpp
runDoubleNH2LJ.cpp		runDoubleNH2LJ.cpp
runExternalField.cpp		runExternalField.cpp
runFlow.cpp		runFlow.cpp
runKuramoto.cpp		runKuramoto.cpp
runNH.cpp		runNH.cpp
runNH2LJ.cpp		runNH2LJ.cpp
runNPT.cpp		runNPT.cpp
runNVE.cpp		runNVE.cpp
runNVE2LJ.cpp		runNVE2LJ.cpp
runNVT.cpp		runNVT.cpp
runNVT2LJ.cpp		runNVT2LJ.cpp
runWall.cpp		runWall.cpp
shearActive.cpp		shearActive.cpp
shearNVT.cpp		shearNVT.cpp
testAreaNVE2LJ.cpp		testAreaNVE2LJ.cpp
testDynamics.cpp		testDynamics.cpp
testInteraction.cpp		testInteraction.cpp

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cudaSoft

Soft particle simulator for molecular dynamics and energy minimization, written in CUDA and C++

Current version includes:

2D and 3D particles in Lees-Edwards, fixed and periodic boundary conditions
Molecular dynamics in the NVE and NVT ensembles
Interaction potentials: harmonic, Lennard-Jones potential
Active brownian model for self-propulsion

Please contact me at arceri.fra at gmail.com for more info

Example of self-propelled particles in Langevin dynamics forming and dissolving clusters (color-labeled by cluster size)

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Soft particle simulator for molecular dynamics and energy minimization, written in CUDA and C++

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