Part 5 - Interconverting with other Packages#
Another powerful feature of
sire is the ability to interconvert
and work with other molecular modelling python packages.
This chapter will teach you how to do the conversion, and also how
this conversion is used in
sire to add functionality such as creation
of molecules from smiles strings, rendering two-dimensional structure
views of molecules, performing molecular dynamics and minimisation,
and parameterising and solvating molecules.