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Mol Sol

Backend code used in mol.dev

Quickstart 🔥

pip install molsol
from molsol import KDESol

model = KDESol()

# predict solubility of a molecule
smiles = "CCO"
solubility = model.predict(smiles)
print(solubility)

Metadata

Release files for molsol 0.0.3

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Source distribution (sdist)

Source distribution for molsol 0.0.3
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molsol-0.0.3.tar.gz 7.1 MB Details

Built distribution (wheel)

Table of built distributions (wheels) for molsol 0.0.3
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molsol-0.0.3-py3-none-any.whl Python 3 none any Details

Total release size: 14.2 MB

Release files / molsol-0.0.3.tar.gz

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Release files / molsol-0.0.3-py3-none-any.whl

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Size 7.1 MB
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0.0.3 This release

2 release files

0.0.1

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