| |
| 2008 | ||
|---|---|---|
| 5 | EE | Pablo Echenique, José Luis Alonso: Efficient model chemistries for peptides. I. General framework and a study of the heterolevel approximation in RHF and MP2 with Pople split-valence basis sets. Journal of Computational Chemistry 29(9): 1408-1422 (2008) |
| 2006 | ||
| 4 | EE | Pablo Echenique, José Luis Alonso: Definition of Systematic, Approximately Separable, and Modular Internal Coordinates (SASMIC) for macromolecular simulation. Journal of Computational Chemistry 27(10): 1076-1087 (2006) |
| 3 | EE | Pablo Echenique, Iván Calvo, José Luis Alonso: Quantum mechanical calculation of the effects of stiff and rigid constraints in the conformational equilibrium of the alanine dipeptide. Journal of Computational Chemistry 27(14): 1733-1747 (2006) |
| 2 | EE | Pablo Echenique, Iván Calvo: Explicit factorization of external coordinates in constrained statistical mechanics models. Journal of Computational Chemistry 27(14): 1748-1755 (2006) |
| 1 | EE | José Luis Alonso, Pablo Echenique: A physically meaningful method for the comparison of potential energy functions. Journal of Computational Chemistry 27(2): 238-252 (2006) |
| 1 | José Luis Alonso | [1] [3] [4] [5] |
| 2 | Iván Calvo | [2] [3] |