pub_soft/openfe
3
0
Fork 0
mirror of https://github.com/OpenFreeEnergy/openfe.git synced 2026-06-04 14:14:22 +08:00
Code Issues Packages Projects Releases Wiki Activity

expose KartografAtomMapper alongside other AtomMappers (#1751)

Browse Source
This commit is contained in:
Alyssa Travitz
2025-12-16 15:38:45 -08:00
committed by GitHub
parent 3d654473bd
commit ea1ae647db
2 changed files with 2 additions and 0 deletions
Download Patch File Download Diff File Expand all files Collapse all files

1
docs/reference/api/atom_mappers.rst
View File

@@ -21,6 +21,7 @@ Tools for mapping atoms in one molecule to those in another. Used to generate ef
:nosignatures:
:toctree: generated/
KartografAtomMapper
LomapAtomMapper
PersesAtomMapper

1
openfe/__init__.py
View File

@@ -71,6 +71,7 @@ from gufe.protocols import (
from . import analysis, orchestration, setup, utils
from .setup import (
KartografAtomMapper,
LigandAtomMapper,
LigandNetwork,
LomapAtomMapper,