peppr.IntraLigandLDDTScore

class peppr.IntraLigandLDDTScore

Compute the local Distance Difference Test (lDDT) score for contacts within each small molecule.

__init__() → None

Methods

__init__()
evaluate(reference, pose)	Apply this metric on the given predicted pose with respect to the given reference.
smaller_is_better()	Whether as smaller value of this metric is considered a better prediction.

Attributes

name
thresholds