Autogenerated Tag Syntax Documentation:

Calculates the McCoy, Chandana, Colman Electrostatic complementarity using APBS.

<ElectrostaticComplementarityMetric name="(&string;)" custom_type="(&string;)"
ignore_radius="(20 &real;)" interface_trim_radius="(1.5 &real;)"
partially_solvated="(1 &bool;)" jump="(1 &integer;)"
report_all_ec="(0 &bool;)" residue_selector1="(&string;)"
residue_selector2="(&string;)" />
• custom_type: Allows multiple configured SimpleMetrics of a single type to be called in a single RunSimpleMetrics and SimpleMetricFeatures. The custom_type name will be added to the data tag in the scorefile or features database.
• ignore_radius: How far away from the interface should atoms be ignored. -1 to keep everything. (15 Shows variation of about 0.001. 10 ~ 0.01)
• interface_trim_radius: Value for the SC filter. How far from the sasa surface should the molecular dots be trimmed? The original paper used 0 here.
• partially_solvated: If false, then fully solvated. When partially solvated, the other side of the pose is present but has 0 charge. If fully solvated, the other side of the pose is not present and solvent fills its place.
• jump: Which jump over which to calculate the interface.
• report_all_ec: Do you want to see the sub correlations? (The normally reported values are the averages of interface 1 and 2)
• residue_selector1: Explicitly set which residues are on each side of the interface using residue_selectors.
• residue_selector2: Explicitly set which residues are on each side of the interface using residue_selectors.