numpy>=1.26
rdkit>=2023.9
selfies>=2.1

[all]
osmiumchem[neural,parquet,representations,testing]

[neural]
jax>=0.10
flax>=0.12
optax>=0.2
jax-cddd>=0.1
jax-grover>=0.2

[parquet]
pyarrow>=15

[representations]
deepsmiles>=1.0

[testing]
pytest
