We introduce a class of generalized DNF formulae called wDNF or weighted disjunctive normal form, and present a molecular algorithm that learns a wDNF formula from training example...
The objective of Molecular Dynamics (MD) simulations is to determine the shape of a molecule in a given biomolecular environment. These simulations are very demanding computationa...
The sparse grid discretization technique enables a compressed representation of higher-dimensional functions. In its original form, it relies heavily on recursion and complex data...
Alin Florindor Murarasu, Josef Weidendorfer, Gerri...
Recent work by the ‘CombeChem’ project together with the UK National Crystallography Service (NCS) has integrated the NCS into an e-Science environment. The existing high-thro...
Jeremy G. Frey, Sam Peppe, Mike Surridge, Ken Meac...
-- To date, not enough attention has been paid to issues surrounding the description and enforcement of policies for controlling Grid resources. These policies define the permitted...