MD | Molecular Dynamics |
PE | Polyethylene |
UA | United Atom |
OP | Order Parameter |
DEB | Directional Entropy Bands |
UMAP | Uniform Manifold Approximation and Projection |
SOAP | Smooth Overlap of Atomic Positions |
HDBSCAN | Hierarchical Density-Based Spatial Clustering of Applications with Noise |
ROC | Receiver Operating Characteristic |
AUC | Area Under the Curve (of the ROC) |
SHAP | SHapley Additive exPlanations |