Upcoming changes in Interchange 0.4
The 0.4.x line of releases will be limited to the following upstream versions:
Python >=3.10
Pydantic v2
Openff Toolkit >=0.15
The following attributes have been renamed and deprecated since version 0.3.0 and will be removed:
Interchange.handlers
was renamed toInterchange.collections
Collection.slot_map
was renamed toCollection.key_map
Note that this applies to all collections, i.e.
SMIRNOFFProperTorsionCollection
is a subclass ofCollection
The +
operator on Interchange
objects, which has only been supported on an experimental basis, is removed and its functionality moved to Interchange.combine
.