DistanceBetweenCentersOfMass ---------------------------- The DistanceBetweenCentersOfMass step calculates and records the distances between the centers of mass of specified groups of particles. Output format: .. code-block:: # step distance_group_pair_1 distance_group_pair_2 distance_group_pair_3 ... 0 5.678 10.123 15.456 100 5.789 10.234 15.567 200 5.890 10.345 15.678 ---- * **type**: ``GeometricalMeasure``, ``DistanceBetweenCentersOfMass`` * **parameters**: * ``outputFilePath``: ``string``: Path to the output file * **data**: * ``name``: ``string``: Name of the group * ``id_list``: ``int[]``: List of particle IDs in the group Example: .. code-block:: "comDistances":{ "type":["GeometricalMeasure","DistanceBetweenCentersOfMass"], "parameters":{ "intervalStep": 10000, "outputFilePath": "com_distances.dat" }, "labels":["idSet_i","idSet_j"], "data":[ [[1, 2, 3, 4, 5],[6, 7, 8, 9, 10]], [[11, 12, 13, 14, 15],[16, 17, 18, 19, 20]], [[21, 22, 23, 24, 25],[26, 27, 28, 29, 30]] ] } .. note:: The output file will contain the step number and the distances between all pairs of specified groups. .. tip:: This measure is useful for tracking the relative motion of different parts of the system, such as in protein-ligand interactions or polymer aggregation studies.