Osmar Norberto de Souza

Effect of periodic box size on aqueous molecular dynamics simulation of a DNA dodecamer with particle-mesh Ewald method

Osmar Norberto de Souza, Rick L. Ornstein · Biophysical Journal · 1997 · 102 citations · Full text

Natural Sciences, Biophysics, Physics +13

Discovery of New Inhibitors of <i>Mycobacterium tuberculosis</i> InhA Enzyme Using Virtual Screening and a 3D-Pharmacophore-Based Approach

Ivaní Pauli, Ricardo Nascimento dos Santos, Diana Carolina Rostirolla et al. · Journal of Chemical Information and Modeling · 2013 · 82 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +17

Determination of Two Structural Forms of Catalytic Bridging Ligand in Zinc−Phosphotriesterase by Molecular Dynamics Simulation and Quantum Chemical Calculation

Chang‐Guo Zhan, Osmar Norberto de Souza, Robert C. Rittenhouse et al. · Journal of the American Chemical Society · 1999 · 81 citations

Natural Sciences, Chemistry, Crystal Structure +13

Molecular Dynamics Simulations of a Protein-Protein Dimer: Particle-Mesh Ewald Electrostatic Model Yields Far Superior Results to Standard Cutoff Model

Osmar Norberto de Souza, Rick L. Ornstein · Journal of Biomolecular Structure and Dynamics · 1999 · 74 citations

Natural Sciences, Biochemistry, Biophysics +17

Crystallographic and Pre-steady-state Kinetics Studies on Binding of NADH to Wild-type and Isoniazid-resistant Enoyl-ACP(CoA) Reductase Enzymes from Mycobacterium tuberculosis

Jaim Simões de Oliveira, J.H. Pereira, Fernanda Canduri et al. · Journal of Molecular Biology · 2006 · 68 citations

Life Sciences, Biochemistry, Molecular Biology +17