| 1 |
Unraveling the Addition-Elimination Mechanism of EPSP Synthase through Computer Modeling
dos Santos AM, Lima AH, Alves CN, Lameira J
Journal of Physical Chemistry B, 121(37), 8626, 2017 |
| 2 |
Structure and analgesic properties of layered double hydroxides intercalated with low amounts of ibuprofen
Sousa R, Jouin J, Masson O, Remondiere F, Lemarchand A, Colas M, Thomas P, Lameira J, Bastos GNT, Lima AB, Nascimento JLM, Anicete-Santos M, Monteiro WR, Alves CN
Journal of the American Ceramic Society, 100(6), 2712, 2017 |
| 3 |
Enhancing Paradynamics for QM/MM Sampling of Enzymatic Reactions
Lameira J, Kupchencko I, Warshel A
Journal of Physical Chemistry B, 120(9), 2155, 2016 |
| 4 |
Metal-dependent inhibition of HIV-1 integrase by 5CITEP inhibitor: A theoretical QM/MM approach
do Nascimento JP, Silva JRA, Lameira J, Alves CN
Chemical Physics Letters, 583, 175, 2013 |
| 5 |
Application of Mangifera indica (mango) seeds as a biosorbent for removal of Victazol Orange 3R dye from aqueous solution and study of the biosorption mechanism
Alencar WS, Acayanka E, Lima EC, Royer B, de Souza FE, Lameira J, Alves CN
Chemical Engineering Journal, 209, 577, 2012 |
| 6 |
A quantum mechanical/molecular mechanical study of the aspartic protease plasmepsin IV complexed with allophenylnorstatine-based inhibitor
Silva ND, Lameira J, Alves CN
Chemical Physics Letters, 509(4-6), 169, 2011 |
| 7 |
A theoretical study of the molecular mechanism of the GAPDH Trypanosoma cruzi enzyme involving iodoacetate inhibitor
Carneiro AS, Lameira J, Alves CN
Chemical Physics Letters, 514(4-6), 336, 2011 |
| 8 |
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 |
| 9 |
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 |
| 10 |
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 |
