GLYCAM06: a generalizable biomolecular force field. Carbohydrates KN Kirschner, AB Yongye, SM Tschampel, J González‐Outeiriño, ... Journal of computational chemistry 29 (4), 622-655, 2008 | 2212 | 2008 |
Why Are Silyl Ethers Conformationally Different from Alkyl Ethers? Chair− Chair Conformational Equilibria in Silyloxycyclohexanes and Their Dependence on the Substituents on … CH Marzabadi, JE Anderson, J Gonzalez-Outeirino, PRJ Gaffney, ... Journal of the American Chemical Society 125 (49), 15163-15173, 2003 | 70 | 2003 |
Structural elucidation of type III group B Streptococcus capsular polysaccharide using molecular dynamics simulations: the role of sialic acid J González-Outeiriño, R Kadirvelraj, RJ Woods Carbohydrate research 340 (5), 1007-1018, 2005 | 68 | 2005 |
Reconciling solvent effects on rotamer populations in carbohydrates A joint MD and NMR analysis J Gonzalez-Outeiriño, KN Kirschner, S Thobhani, RJ Woods Canadian journal of chemistry 84 (4), 569-579, 2006 | 66 | 2006 |
Understanding the bacterial polysaccharide antigenicity of Streptococcus agalactiae versus Streptococcus pneumoniae R Kadirvelraj, J Gonzalez-Outeiriño, BL Foley, ML Beckham, HJ Jennings, ... Proceedings of the National Academy of Sciences 103 (21), 8149-8154, 2006 | 59 | 2006 |
The Conformational Properties of Methyl α-(2,8)-Di/Trisialosides and Their N-Acyl Analogues: Implications for Anti-Neisseria meningitidis B Vaccine Design AB Yongye, J Gonzalez-Outeiriño, J Glushka, V Schultheis, RJ Woods Biochemistry 47 (47), 12493-12514, 2008 | 51 | 2008 |
Conformation of Acetate Derivatives of Sugars and Other Cyclic Alcohols. Crystal Structures, NMR Studies, and Molecular Mechanics Calculations of Acetates. When Is the … J González-Outeiriño, R Nasser, JE Anderson The Journal of Organic Chemistry 70 (7), 2486-2493, 2005 | 23 | 2005 |
The structure and conformational behavior of sulfonium salt glycosidase inhibitors in solution: A combined quantum mechanical NMR approach J Gonzalez-Outeiriño, J Glushka, A Siriwardena, RJ Woods Journal of the American Chemical Society 126 (22), 6866-6867, 2004 | 17 | 2004 |
GLYCAM06: A generalizable Biomolecular force field. Carbohydrates RJ Woods, KN Kirschner, AB Yongye, SM Tschampel, ... J Comput Chem 29, 622-655, 2008 | 13 | 2008 |
CARB 43-GLYCAM06, a generalizable biomolecular force field: Carbohydrates, lipids, lipid bilayers and glycolipids AB Yongye, MB Tessier, K Kirschner, SM Tschampel, ... ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 235, 2008 | 2 | 2008 |
Computational analyses of the structural properties that mediate the immunogenicity of capsular polysaccharides of Neisseria meningitidis AB Yongye, J Gonzalez-Outeirino, J Glushka, R Woods ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 231, 2006 | | 2006 |
Understanding carbohydrate antigenicity: Streptococcus agalaetiae (type III) versus Streptococcus pneumoniae (type 14) R Kadirvelraj, J Gonzalez-Outeirino, HJ Jennings, S Foote, RJ Woods GLYCOBIOLOGY 15 (11), 1187-1187, 2005 | | 2005 |
Conformation of acetate derivatives of sugars and other cyclic alcohols. Crystal structures, NMR studies, and molecular mechanics calculations of acetates. When is the … R Nasser, J Gonzalez-Outeirino, JE Anderson | | 2005 |
CONFORMATIONAL ANALYSIS OF oGM3 AND Gal-GM3 S Mari, J Gonzalez-Outeiriño, JH Prestegard, RJ Woods, A Bernardi, ... | | |