/tools/PharmacoNet
PharmacoNet
SeonghwanSeo/PharmacoNet
summary
PharmacoNet is an open-source tool for protein-based pharmacophore modeling that utilizes deep learning for ultra-large-scale virtual screening. It automates the evaluation of ligands and supports feature extraction for deep learning applications in drug discovery.
description
Official Github for "PharmacoNet: deep learning-guided pharmacophore modeling for ultra-large-scale virtual screening" (Chemical Science)
topics
deep-learningdrug-discoveryinstance-segmentationmachine-learningpharmacophore-modellingvirtual-screeningpharmacophore
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