화학공학소재연구정보센터
검색결과 : 4건
No. Article
1 Derivation of Fixed Partial Charges for Amino Acids Accommodating a Specific Water Model and Implicit Polarization
Cerutti DS, Rice JE, Swope WC, Case DA
Journal of Physical Chemistry B, 117(8), 2328, 2013
2 Peptide Crystal Simulations Reveal Hidden Dynamics
Janowski PA, Cerutti DS, Holton J, Case DA
Journal of the American Chemical Society, 135(21), 7938, 2013
3 Simulations of a Protein Crystal with a High Resolution X-ray Structure: Evaluation of Force Fields and Water Models
Cerutti DS, Freddolino PL, Duke RE, Case DA
Journal of Physical Chemistry B, 114(40), 12811, 2010
4 Dynamics of the Streptavidin-Biotin Complex in Solution and in Its Crystal Lattice: Distinct Behavior Revealed by Molecular Simulations
Cerutti DS, Le Trong I, Stenkamp RE, Lybrand TP
Journal of Physical Chemistry B, 113(19), 6971, 2009