MHCXGraph.utils.tools.execute_step

MHCXGraph.utils.tools.execute_step(step_idx: int, graph_collection, max_chunks: int, current_filtered_cross_combos, graphs_data, global_state, residue_tracker)[source]

Execute a single hierarchical association step.

Parameters:

  • step_idx (int) – Current step index.

  • graph_collection (dict) – Graph collection produced during preprocessing.

  • max_chunks (int) – Maximum chunk size used for hierarchical grouping.

  • current_filtered_cross_combos (list) – Cross-combo results from the previous step.

  • graphs_data (list) – Graph metadata structures.

  • global_state (dict) – Shared global state containing matrices, maps, and configuration parameters.

  • residue_tracker (ResidueTracker, optional) – Tracking object used for debugging and provenance logging.

Returns:

  • filtered_cross_combos (list) – Filtered cross combinations for the next step.

  • step_graphs (list) – Graphs produced during the step.