for testing and deploying your application
for finding and fixing issues
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from __future__ import annotations
from dataclasses import dataclass
from mandos.model import CompoundNotFoundError, CompoundStruct
class ChemblCompoundLookupError(CompoundNotFoundError):
""" """
@dataclass(frozen=True, order=True, repr=True)
class ChemblCompound:
chid: str
inchikey: str
name: str
inchi: str
@property
def struct_view(self) -> CompoundStruct:
return CompoundStruct(
"chembl",
self.chid,
self.inchi,
self.inchikey,
)
__all__ = [
"ChemblCompound",
"ChemblCompoundLookupError",
]
dmyersturnbull /
mandos
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