Structural Bioinformatics Library
Template C++ / Python API for developping structural bioinformatics applications.
Space_filling_model_shelling_diagram_surface_encoding

Consider a binding patch i.e.. the atoms of a complex directly in contact with a partner. Space_filling_model_shelling_diagram_surface_encoding is a package providing several encodings of a binding patch, and notably the atom shelling tree, which generalizes core-rim models. Binding patches can be compared using the applications of Space_filling_model_shelling_diagram_comparison. Reference ManualUser Manual . Authors: F. Cazals and T. Dreyfus

Main classes: