화학공학소재연구정보센터
검색결과 : 11건
No. Article
1 Influence of canonical structure determining residues on antibody affinity and stability
Clark LA, Demarest SJ, Eldredge J, Jarpe MB, Li Y, Simon K, van Vlijmen HWT
Journal of Structural Biology, 185(2), 223, 2014
2 Simulated adsorption properties and synthesis prospects of homochiral porous solids based on their heterochiral analogs
Clark LA, Chempath S, Snurr RQ
Langmuir, 21(6), 2267, 2005
3 Computational elucidation of the transition state shape selectivity phenomenon
Clark LA, Sierka M, Sauer J
Journal of the American Chemical Society, 126(3), 936, 2004
4 Two general methods for grand canonical ensemble simulation of molecules with internal flexibility
Chempath S, Clark LA, Snurr RQ
Journal of Chemical Physics, 118(16), 7635, 2003
5 Stable mechanistically-relevant aromatic-based carbenium ions in zeolite catalysts
Clark LA, Sierka M, Sauer J
Journal of the American Chemical Society, 125(8), 2136, 2003
6 Characterization of acidic OH groups in zeolites of different types: An interpretation of NH3-TPD results in the light of confinement effects
Hunger B, Heuchel M, Clark LA, Snurr RQ
Journal of Physical Chemistry B, 106(15), 3882, 2002
7 A Fukui function overlap method for predicting reactivity in sterically complex systems
Clark LA, Ellis DE, Snurr RQ
Journal of Chemical Physics, 114(6), 2580, 2001
8 Siting of mixtures in mordenite zeolites: F-19 and Xe-129 NMR and molecular simulation
Yang JH, Clark LA, Ray GJ, Kim YJ, Du H, Snurr RQ
Journal of Physical Chemistry B, 105(20), 4698, 2001
9 Grand canonical Monte Carlo simulations of nonrigid molecules: Siting and segregation in silicalite zeolite
Gupta A, Clark LA, Snurr RQ
Langmuir, 16(8), 3910, 2000
10 Diffusion mechanisms of normal alkanes in faujasite zeolites
Clark LA, Ye GT, Gupta A, Hall LL, Snurr RQ
Journal of Chemical Physics, 111(3), 1209, 1999