requests>=2.27.1
ipython
numpy>=1.21.6
scipy>=1.7.3
pandas>=1.3.5
pebble>=4.6.3
nglview>=3.0.3
rdkit-pypi>=2022.3.2.1
rdkit-to-params>=1.2.1
molecular-rectifier>=0.1.6
singledispatchmethod>=1.0
typing_extensions>=4.2.0
singledispatchmethod>=1.0
matplotlib>=3.5.2
smallworld-api>=1.1
sqlitedict>=2.0.0

[jupyter]
jupyter
