| 2009 | ||
|---|---|---|
| 8 | Sangwook Wu, Vasu Chandrasekaran, Lee G. Pedersen: Free Energy Correction to Rigid Body Docking : Application to the Colicin E7 and Im7 Complex. ICCS (2) 2009: 221-228 | |
| 2002 | ||
| 7 | Lalith E. Perera, Thomas A. Darden, Lee G. Pedersen: Predicted solution structure of zymogen human coagulation FVII. Journal of Computational Chemistry 23(1): 35-47 (2002) | |
| 2001 | ||
| 6 | Leping Li, Clarice R. Weinberg, Thomas A. Darden, Lee G. Pedersen: Gene selection for sample classification based on gene expression data: study of sensitivity to choice of parameters of the GA/KNN method. Bioinformatics 17(12): 1131-1142 (2001) | |
| 2000 | ||
| 5 | Jose M. Mercero, Paul Barrett, Cheuk W. Lam, Joseph E. Fowler, Jesus M. Ugalde, Lee G. Pedersen: Quantum mechanical calculations on phosphate hydrolysis reactions. Journal of Computational Chemistry 21(1): 43-51 (2000) | |
| 4 | Gilles Tiraboschi, Nohad Gresh, Claude Giessner-Prettre, Lee G. Pedersen, David W. Deerfield: Parallel ab initio and molecular mechanics investigation of polycoordinated Zn(II) complexes with model hard and soft ligands: Variations of binding energy and of its components with number and charges of ligands. Journal of Computational Chemistry 21(12): 1011-1039 (2000) | |
| 1997 | ||
| 3 | Thomas A. Darden, Lee G. Pedersen, Abdulnour Toukmaji, Michael Crowley, Thomas Cheatham: Particle-Mesh Based Methods for Fast Ewald Summation in Molecular Dynamics Simulations. PPSC 1997 | |
| 1994 | ||
| 2 | Darrin M. York, Lee J. Bartolotti, Thomas A. Darden, Lee G. Pedersen, M. W. Anderson: Simulations of the Solution Structure of HIV-1 Protease in the Presence and Absence of Bound Zinc. Journal of Computational Chemistry 15(1): 61-71 (1994) | |
| 1977 | ||
| 1 | Lee G. Pedersen, G. L. Carison: Molecular fragment transfer in ab initio calculations. Computers & Chemistry 1(2): 137-138 (1977) | |