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pyrosage-pka_acidic-attentivefp

Tabular Regression

molecular-property-prediction

graph-neural-networks

pytorch-geometric

toxicity-prediction

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pyrosage-pka_acidic-attentivefp / requirements.txt

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Upload pKa_acidic AttentiveFP model

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	torch>=1.9.0
	torch-geometric>=2.0.0
	rdkit-pypi>=2022.3.0
	numpy>=1.21.0