검색결과 : 30건
| No. | Article |
|---|---|
| 1 |
Theoretical Study of the Mechanism of Exemestane Hydroxylation Catalyzed by Human Aromatase Enzyme Viciano I, Marti S Journal of Physical Chemistry B, 120(13), 3331, 2016 |
| 2 |
Peptide Bond Formation Mechanism Catalyzed by Ribosome Swiderek K, Marti S, Tunon I, Moliner V, Bertran J Journal of the American Chemical Society, 137(37), 12024, 2015 |
| 3 |
Role of Solvent on Nonenzymatic Peptide Bond Formation Mechanisms and Kinetic Isotope Effects Swiderek K, Tunon I, Marti S, Moliner V, Bertran J Journal of the American Chemical Society, 135(23), 8708, 2013 |
| 4 |
Increased Dynamic Effects in a Catalytically Compromised Variant of Escherichia coli Dihydrofolate Reductase Ruiz-Pernia JJ, Luk LYP, Garcia-Meseguer R, Marti S, Loveridge EJ, Tunon I, Moliner V, Allemann RK Journal of the American Chemical Society, 135(49), 18689, 2013 |
| 5 |
Enzyme Molecular Mechanism as a Starting Point to Design New Inhibitors: A Theoretical Study of O-GIcNAcase Lameira J, Alves CN, Tunon I, Marti S, Moliner V Journal of Physical Chemistry B, 115(20), 6764, 2011 |
| 6 |
Temperature Dependence of the Kinetic Isotope Effects in Thymidylate Synthase. A Theoretical Study Kanaan N, Ferrer S, Marti S, Garcia-Viloca M, Kohen A, Moliner V Journal of the American Chemical Society, 133(17), 6692, 2011 |
| 7 |
A Quantum Mechanics/Molecular Mechanics Study of the Protein-Ligand Interaction of Two Potent Inhibitors of Human O-GIcNAcase: PUGNAc and NAG-Thiazoline (vol 112, pg 14620, 2008) Lameira J, Alves CN, Moliner V, Marti S, Kanaan N, Tunon I Journal of Physical Chemistry B, 114(5), 2090, 2010 |
| 8 |
Quantum Mechanical/Molecular Mechanical Molecular Dynamics Simulation of Wild-Type and Seven Mutants of CpNagJ in Complex with PUGNAc Lameira J, Alves CN, Moliner V, Marti S, Castillo R, Tunon I Journal of Physical Chemistry B, 114(20), 7029, 2010 |
| 9 |
Application of Grote-Hynes Theory to the Reaction Catalyzed by Thymidylate Synthase Kanaan N, Roca M, Tunon I, Marti S, Moliner V Journal of Physical Chemistry B, 114(42), 13593, 2010 |
| 10 |
QM/MM Study of Thymidylate Synthase: Enzymatic Motions and the Temperature Dependence of the Rate Limiting Step Kanaan N, Marti S, Moliner V, Kohen A Journal of Physical Chemistry A, 113(10), 2176, 2009 |