Merge pull request #13 from MobleyLab/clustering

Ligand binding mode clustering with PyEMMA
MobleyLab · Nov 11, 2017 · 62a6906 · 62a6906
2 parents 793ee7b + 98fa1fb
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diff --git a/uci-pharmsci/lectures/cluster_and_visualize/4XH_1-bmodes-freq.png b/uci-pharmsci/lectures/cluster_and_visualize/4XH_1-bmodes-freq.png
diff --git a/uci-pharmsci/lectures/cluster_and_visualize/4XH_1-md_subsamp.nc b/uci-pharmsci/lectures/cluster_and_visualize/4XH_1-md_subsamp.nc
diff --git a/uci-pharmsci/lectures/cluster_and_visualize/4XH_1-top.pdb b/uci-pharmsci/lectures/cluster_and_visualize/4XH_1-top.pdb
diff --git a/uci-pharmsci/lectures/cluster_and_visualize/6NX_1-blues_subsamples.dcd b/uci-pharmsci/lectures/cluster_and_visualize/6NX_1-blues_subsamples.dcd
diff --git a/uci-pharmsci/lectures/cluster_and_visualize/6NX_1-leaders-5.nc b/uci-pharmsci/lectures/cluster_and_visualize/6NX_1-leaders-5.nc
diff --git a/uci-pharmsci/lectures/cluster_and_visualize/6NX_1-lig-bar_freq.png b/uci-pharmsci/lectures/cluster_and_visualize/6NX_1-lig-bar_freq.png
diff --git a/uci-pharmsci/lectures/cluster_and_visualize/6NX_1-top.pdb b/uci-pharmsci/lectures/cluster_and_visualize/6NX_1-top.pdb
diff --git a/uci-pharmsci/lectures/cluster_and_visualize/PyEMMA-Ligand_binding_mode_clustering.ipynb b/uci-pharmsci/lectures/cluster_and_visualize/PyEMMA-Ligand_binding_mode_clustering.ipynb