A novel volumetric criterion for optimal shape matching of surfaces for protein-protein docking
HK Voruganti, B Dasgupta - Journal of Computational Design …, 2018 - academic.oup.com
The problem of molecular docking is to predict whether two given molecules bind together to
interact. A shape-based algorithm is proposed for predictive docking by noting that shape …
interact. A shape-based algorithm is proposed for predictive docking by noting that shape …
[PDF][PDF] Surface and volumetric parametrisation using harmonic functions in non-convex domains
R Klein - 2014 - core.ac.uk
Many of the problems in mathematics have very elegant solutions. As complex, real–world
geometries come into play, however, this elegance is often lost. This is particularly the case …
geometries come into play, however, this elegance is often lost. This is particularly the case …