GitPlanet
Projects
Users
Categories
Languages
About
All Categories
→
No Category
→ enhanced-sampling
Top 4 enhanced-sampling open source projects
SML CV
Using supervised machine learning to build collective variables for accelerated sampling
✭ 20
Jupyter Notebook
machine-learning
openmm
supervised-learning
enhanced-sampling
plumed
supervised-machine-learning
metadynamics
collective-variables
accelerated-sampling
DISCOTRESS
🦜 DISCOTRESS 🦜 is a software package to simulate and analyse the dynamics on arbitrary Markov chains
✭ 20
C++
shell
markov-model
simulation
markov-chain
kinetic-monte-carlo
markov-chains
stochastic-processes
stochastic-simulation-algorithm
markov-process
random-walk
ctmc
enhanced-sampling
stochastic-simulation
dtmc
network-dynamics
rare-events
k-shortest-paths
markovian-dynamics
continuous-time-markov-chain
simulation-algorithms
SSAGES
Software Suite for Advanced General Ensemble Simulations
✭ 72
C++
CMake
python
shell
lammps
gromacs
enhanced-sampling
qbox
collective-variables
hoomd-blue
scientific-machine-learning
miccom
wepy
Weighted Ensemble simulation framework in Python
✭ 38
python
TeX
shell
HTML
CSS
Makefile
simulation
molecular-dynamics
enhanced-sampling
weighted-ensemble
1-4
of
4
enhanced-sampling projects