Grand Canonical Monte Carlo Simulation of Ligand-Protein Binding. - Matthew Clark 001; Frank Guarnieri; Igor Shkurko; Jeffrey S. Wiseman (J. Chem. Inf. Model., 2006)

Fragment-Based Computation of Binding Free Energies by Systematic Sampling. - Matthew Clark 001; Siavash Meshkat; George T. Talbot; Paolo Carnevali; Jeffrey S. Wiseman (J. Chem. Inf. Model., 2009)

Grand Canonical Free-Energy Calculations of Protein-Ligand Binding. - Matthew Clark 001; Siavash Meshkat; Jeffrey S. Wiseman (J. Chem. Inf. Model., 2009)

Fragment-Based Prediction of the Clinical Occurrence of Long QT Syndrome and Torsade de Pointes. - Matthew Clark 001; Jeffrey S. Wiseman (J. Chem. Inf. Model., 2009)

Transplant-Insert-Constrain-Relax-Assemble (TICRA): Protein-Ligand Complex Structure Modeling and Application to Kinases. - Siavash Meshkat; Anthony E. Klon; Jinming Zou; Jeffrey S. Wiseman; Zenon Konteatis (J. Chem. Inf. Model., 2011)