Posted May. 18, 2017 at 8:30 a.m.

Premium Lock NCSU researchers utilize molecular dynamics, machine learning for drug discovery

Published: 2017-05-18 08:30:00
Updated: 2017-05-18 08:30:00

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Researchers from North Carolina State University have demonstrated that molecular dynamics simulations and machine learning techniques could be integrated to create more accurate computer prediction models. These "hyper-predictive" models could be used to quickly predict which new chemical compounds could be promising drug candidates....

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