| 1 |
Cellulose Chain Binding Free Energy Drives the Processive Move of Cellulases on the Cellulose Surface
Wang YF, Zhang SJ, Song XF, Yao LS
Biotechnology and Bioengineering, 113(9), 1873, 2016 |
| 2 |
A fast computational approach for the determination of thermal properties of hollow bricks in energy-related calculations
Koci J, Madera J, Cerny R
Energy, 83, 749, 2015 |
| 3 |
Disease-associated mutations in the coil 2B domain of human lamin A/C affect structural properties that mediate dimerization and intermediate filament formation
Gangemi F, Degano M
Journal of Structural Biology, 181(1), 17, 2013 |
| 4 |
Molecular dynamics Gibbs free energy calculations for CO2 capture and storage in structure I clathrate hydrates in the presence of SO2, CH4, N-2, and H2S impurities
Nohra M, Woo TK, Alavi S, Ripmeester JA
Journal of Chemical Thermodynamics, 44(1), 5, 2012 |
| 5 |
New Takes on Nitrate Ester Chemistry: Salts with Oxygen-Rich Ammonium Cations
Drake GW, Bolden S, Dailey J, McQuaid MJ, Parrish D
Propellants Explosives Pyrotechnics, 37(1), 40, 2012 |
| 6 |
Partition coefficients of organic molecules in squalane and water/ethanol mixtures by molecular dynamics simulations
Lundsgaard R, Kontogeorgis GM, Economou IG
Fluid Phase Equilibria, 306(2), 162, 2011 |
| 7 |
Molecular simulation of the hydration Gibbs energy of barbiturates
Garrido NM, Jorge M, Queimada AJ, Economou IG, Macedo EA
Fluid Phase Equilibria, 289(2), 148, 2010 |
| 8 |
Solid-liquid phase equilibria for mixtures containing diatomic Lennard-Jones molecules
Galbraith AL, Hall CK
Fluid Phase Equilibria, 262(1-2), 1, 2007 |
| 9 |
Thermodynamic and electrostatic properties of ternary Oxytricha nova TEBP-DNA complex
Wojciechowski M, Fogolari F, Baginski M
Journal of Structural Biology, 152(3), 169, 2005 |
| 10 |
First-principles calculations on the electronic structure of TiCxN1-x, ZrxNb1-xC and HfCxN1-x alloys
Zaoui A, Bouhafs B, Ruterana P
Materials Chemistry and Physics, 91(1), 108, 2005 |
