Category Archives: grants

Extending the aspherical pseudoatom databank versatility with special attention on accurate description of electrostatics

Sławomir Bojarowski, Preludium, 22.06.2016 – 21.06.2018 PRELUDIUM 10-UMO/2015/19/N/ST4/00010 Polish National Science Center Interactions within biomolecular systems depend mostly on electrostatics. Therefore good description of this particular component is a key factor in any bio-simulations. Nowadays most of in vitro experiments are preceded by thoughtful research in silica. The accuracy of those computations is limited since… Read More »