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A code where I trained a machine learning (CNN) model using pytorch to predict the efficacy of a drug using pIC50 as a measure

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HazemAhmad/CNN_DrugDesign

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CNN_DrugDesign

An approach to predict the drug affinities to a specific receptor using convolutional neuronal network. The input is comprised of molecule smiles which are converted to one-hot encoding then the network is trained with the known drug affinities as targets.

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A code where I trained a machine learning (CNN) model using pytorch to predict the efficacy of a drug using pIC50 as a measure

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