CCPBioSim
This is the development repository of the Collaborative Computational Project for Biomolecular Simulation
Popular repositories
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md-workshop
md-workshop PublicWorkshop that teaches how to set up and analyse molecular dynamics simulations
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clustering-workshop
clustering-workshop PublicCluster analysis of MD simulation data using RMSD and PCA methods
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python-and-data-workshop
python-and-data-workshop PublicWorkshop that goes beyond beginner's python to give Jupyter use, intermediate python and data handling with pandas and matplotlib
Repositories
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- docking-workflow Public
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- equilibration-workshop Public
A workshop to demonstrate approaches to assessing equilibration in MD simulations
- BSS_FEP_workshop_2022 Public
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- MDAnalysis_ML_workshop Public
- nemd-workshop Public