Computational Analysis of Energy Landscapes Reveals Dynamic Features that Contribute to Binding of Inhibitors to CFTR-Associated Ligand
G. T. Holt, J. D. Jou, N. P. Gill, A. U. Lowegard, J. W. Martin, D. R. Madden, B. R. Donald
The paper analyzes energy landscapes of CALP-inhibitor complexes to identify structural and dynamic features contributing to binding efficiency of kCAL01.
The Journal of Physical Chemistry B · Nov 7, 2019Peer-reviewedBiochemistry