Dissecting the role of guanidine copper complexes in atom transfer radical polymerization by density functional theory

Mechanistic studies on the ring-opening polymerisation of D,L-lactide with zinc guanidine complexes

MoSGrid – a molecular simulation grid as a new tool in computational chemistry, biology and material science.

artículo científico publicado en 2011

MoSGrid: efficient data management and a standardized data exchange format for molecular simulations in a grid environment.

artículo científico publicado en 2012

Molecular simulation grid.

artículo científico publicado en 2011

Studies on the mechanism of the lactide polymerization with highly active zinc guanidine catalysts

The MoSGrid - e-science gateway: molecular simulations in a distributed computing environment