Absolute Net Charge and the Biological Activity of Oligopeptides. - Laavanya Parthasarathi; Marc Devocelle; Chresten R. Søndergaard; Ivan Baran; Colm O'Dushlaine; Norman E. Davey; Richard J. Edwards; Niamh Moran; Dermot Kenny; Denis C. Shields (J. Chem. Inf. Model., 2006)

Virtual Screening Using Combinatorial Cyclic Peptide Libraries Reveals Protein Interfaces Readily Targetable by Cyclic Peptides. - Fergal J. Duffy; Darragh O'Donovan; Marc Devocelle; Niamh Moran; David J. O'Connell; Denis C. Shields (J. Chem. Inf. Model., 2015)

Discovering Anti-platelet Drug Combinations with an Integrated Model of Activator-Inhibitor Relationships, Activator-Activator Synergies and Inhibitor-Inhibitor Synergies. - Federica Lombardi; Kalyan Golla; Darren J. Fitzpatrick; Fergal P. Casey; Niamh Moran; Denis C. Shields (PLoS Comput. Biol., 2015)