SophosQM: Accurate Binding Affinity Prediction in Compound Optimization
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DOI: 10.1021/acsomega.2c08132
Abstract: The optimization of compounds’ binding affinity for a biological target is a crucial aspect of the drug development process. Being able to accurately predict binding energies in advance of synthesizing compounds would have a massive… read more here.
Keywords: binding affinity; affinity; sophosqm; affinity prediction ... See more keywords