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Structure and Ligand-based Virtual Screening using AI
Virtual screening is used for identifying small chemical compounds that bind to a drug target. Ligand-based VS is different from Structure based as it does not depend on the 3-D structure of the target protein and hence, has a lower accuracy.
Machine learning has the capability of speeding up VS and producing more accuracy by generating less false positives.
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Related
Peptide synthesis and Small Molecule design using AI
Identification of drug dosage using AI
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Prediction of protein-protein interactions through AI
Identification of protein folding and misfolding using AI
QSAR modeling using AI
Prediction of physiochemical and bioactive properties using AI