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

Data structures and algorithms for computing the interface patches between different partners in a molecule Reference ManualUser Manual . Authors: F. Cazals and T. Dreyfus

Main classes:

  • T_Molecular_interfaces_builder :

Construct all the primitive and hierarchical interfaces associated to a molecular model represented by an alpha-complex.

  • T_Molecular_interfaces_traits : Traits class defining the different kind of molecular interfaces.