Pinned Repositories
deeptime
Python library for analysis of time series data including dimensionality reduction, clustering, and Markov model estimation
PyEMMA
🚂 Python API for Emma's Markov Model Algorithms 🚂
pyemma_tutorials
How to analyze molecular dynamics data with PyEMMA
adaptivemd
A python framework to run adaptive Markov state model (MSM) simulation on HPC resources
bhmm
Bayesian hidden Markov models toolkit
drunken-markov
Markov state model analysis and estimation pipeline
EvoThesis
EvoThesis-backbone
information
mdshare-feedstock
A conda-smithy repository for mdshare.
thempel's Repositories
thempel/EvoThesis
thempel/adaptivemd
A python framework to run adaptive Markov state model (MSM) simulation on HPC resources
thempel/bhmm
Bayesian hidden Markov models toolkit
thempel/drunken-markov
Markov state model analysis and estimation pipeline
thempel/EvoThesis-backbone
thempel/information
thempel/mdshare-feedstock
A conda-smithy repository for mdshare.
thempel/PyEMMA
Python API for Emma's Markov Model Algorithms
thempel/PyEMMA_IPython
PyEMMA Jupyter Notebooks
thempel/pyemma_tutorials
thempel/python-tutorial
thempel/remd-temperature-generator
Temperature generator for Replica Exchange MD simulations
thempel/scikit-time