Rapid, precise and reproducible binding affinity prediction : applications in drug discovery

As we move towards an era of personalised medicine, the identification of lead compounds requires years of research and considerable financial backing, in the development of targeted therapies for cancer. We use molecular modelling and simulation to screen a library of active compounds, and understa...

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Bibliographic Details
Main Author: Jovanovic, Srdan
Other Authors: Coveney, P.
Published: University College London (University of London) 2018
Subjects:
540
Online Access:https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.756212