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Author:
Genheden, Samuel
License:
Apache-2.0
Summary:
Utilities for working with reactions, reaction templates and template extraction
Latest version:
1.9.3
Required dependencies:
apted
|
cgrtools-plus
|
dask
|
deprecated
|
metaflow
|
numpy
|
pandas
|
py7zr
|
pydantic
|
pyyaml
|
rdchiral
|
rdkit
|
scipy
|
swifter
|
urllib3
|
wrapt-timeout-decorator
|
xxhash
Optional dependencies:
onnxruntime
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