Structure to name conversion
Using the API for generating the name of a molecule:
Molecule m = ...;
String name = m.toFormat("name");
String traditionalName = m.toFormat("name:t");
See user's documentation of s2n here.
Using the API for generating the name of a molecule:
Molecule m = ...;
String name = m.toFormat("name");
String traditionalName = m.toFormat("name:t");
See user's documentation of s2n here.