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float | protocols::multistage_rosetta_scripts::cluster::distance (utility::vector1< float > const &triangle_matrix, utility::vector1< uint > const &offsets, uint pointA, uint pointB) |
| Looks up the distance between two points in the tricky triangle matrix I hacked together. More...
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unsigned long long int | protocols::multistage_rosetta_scripts::cluster::number_of_elements_in_exclusive_upper_triangle (unsigned short int const num_points) |
| maybe this is lazy programming on my part. I just want to count how many possible interacitons there are without using math. Feel free to replace this with a simple equation. More...
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void | protocols::multistage_rosetta_scripts::cluster::initialize_offsets (utility::vector1< uint > &offsets, uint const num_points) |
| Initialize the offset vector identified in schematic (2) above. More...
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void | protocols::multistage_rosetta_scripts::cluster::assign_initial_medoids (utility::vector1< bool > const &medoids, utility::vector1< uint > &medoid_for_cluster, utility::vector1< uint > &cluster_for_point) |
| This assumes you already created k "true"s in medoids vector. Just goes through and updates medoid_for_cluster and cluster_for_point (but only for medoids) More...
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void | protocols::multistage_rosetta_scripts::cluster::assign_medoids (utility::vector1< float > const &triangle_matrix, utility::vector1< uint > const &offsets, utility::vector1< bool > &medoids, utility::vector1< uint > &medoid_for_cluster, utility::vector1< uint > const &cluster_for_point) |
| Iterates though every point and tests to see if it is the best medoid for its cluster. More...
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core::Real | protocols::multistage_rosetta_scripts::cluster::assign_non_medoids_to_clusters (utility::vector1< float > const &triangle_matrix, utility::vector1< uint > const &offsets, utility::vector1< bool > const &medoids, utility::vector1< uint > const &medoid_for_cluster, utility::vector1< uint > &cluster_for_point) |
| After the medoids have been assigned, go through each point and determine which cluster it is in. Returns total distance cost. More...
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void | protocols::multistage_rosetta_scripts::cluster::k_medoids_with_edge_precalculation (utility::vector1< ClusterMetricCOP > const &points, unsigned short int const num_medoids, utility::vector1< bool > &best_medoids) |
| Finds "num_medoids" number of clusters from within the "points" vector. If a point becomes the center of a cluster, it's index in "medoid_positions" is set to true. False otherwise. medoid_positions.size() will equal points.size() More...
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