v1.3.0
Contents:
Installing Chemist
Chemist Background
Developer Documentation
Design Documentation
Architecture of Chemist
Design of the Chemical System Component
Design of the AO Basis Set Component
Design of the Topology Component
Designing the Topology Component
Designing the Connectivity Table
Design of the Fragmenting Component
Design of the Quantum Mechanics (QM) Component
Developing the Chemical System Component
Creating a New View
Understanding the Traits Component
NWChemEx author documentation
Chemist Tutorials
C++ API
Chemist
Developer Documentation
Design Documentation
Design of the Topology Component
View page source
Design of the Topology Component
The topics in this section describe the design of the Topolgy component of Chemist.
Designing the Topology Component
Designing the Connectivity Table