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Fix: Stop including strained structures by default
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This is causing no end of headaches for me and leads to many issues.
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avcopan committed Dec 12, 2024
1 parent d86e872 commit 16683a4
Showing 1 changed file with 7 additions and 7 deletions.
14 changes: 7 additions & 7 deletions automol/reac/_5conv.py
Original file line number Diff line number Diff line change
Expand Up @@ -30,7 +30,7 @@ def from_graphs(
stereo: bool = True,
struc_typ: str | None = None,
enant: bool = True,
strained: bool = True,
strained: bool = False,
) -> tuple[Reaction, ...]:
"""Get reaction objects from graphs.
Expand Down Expand Up @@ -58,7 +58,7 @@ def from_amchis(
stereo: bool = True,
struc_typ: str | None = None,
enant: bool = True,
strained: bool = True,
strained: bool = False,
) -> tuple[Reaction, ...]:
"""Get reaction objects from AMChIs.
Expand Down Expand Up @@ -86,7 +86,7 @@ def from_inchis(
stereo: bool = True,
struc_typ: str | None = None,
enant: bool = True,
strained: bool = True,
strained: bool = False,
) -> tuple[Reaction, ...]:
"""Get reaction objects from InChIs.
Expand Down Expand Up @@ -114,7 +114,7 @@ def from_chis(
stereo: bool = True,
struc_typ: str | None = None,
enant: bool = True,
strained: bool = True,
strained: bool = False,
) -> tuple[Reaction, ...]:
"""Get reaction objects from ChIs.
Expand Down Expand Up @@ -142,7 +142,7 @@ def from_smiles(
stereo: bool = True,
struc_typ: str | None = None,
enant: bool = True,
strained: bool = True,
strained: bool = False,
) -> tuple[Reaction, ...]:
"""Get reaction objects from SMILES.
Expand Down Expand Up @@ -170,7 +170,7 @@ def from_geometries(
stereo: bool = True,
struc_typ: str | None = "geom",
enant: bool = True,
strained: bool = True,
strained: bool = False,
) -> tuple[Reaction, ...]:
"""Get reaction objects from geometries.
Expand Down Expand Up @@ -202,7 +202,7 @@ def from_zmatrices(
stereo: bool = True,
struc_typ: str | None = "zmat",
enant: bool = True,
strained: bool = True,
strained: bool = False,
) -> tuple[Reaction, ...]:
"""Get reaction objects from z-matrices.
Expand Down

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