화학공학소재연구정보센터
검색결과 : 12건
No. Article
1 Validation of thermophysical data for scientific and engineering applications
Diky V, Bazyleva A, Paulechka E, Magee JW, Martinez V, Riccardi D, Kroenlein K
Journal of Chemical Thermodynamics, 133, 208, 2019
2 Highly mechanosensitive ion channels from graphene-embedded crown ethers
Fang A, Kroenlein K, Riccardi D, Smolyanitsky A
Nature Materials, 18(1), 76, 2019
3 Highly mechanosensitive ion channels from graphene-embedded crown ethers
Fang A, Kroenlein K, Riccardi D, Smolyanitsky A
Nature Materials, 18(1), 76, 2019
4 Mercury Methylation by HgcA: Theory Supports Carbanion Transfer to Hg(II)
Zhou J, Riccardi D, Beste A, Smith JC, Parks JM
Inorganic Chemistry, 53(2), 772, 2014
5 pK(a) analysis for the zinc-bound water in human carbonic anhydrase II: Benchmark for "Multiscale" QM/MM simulations and mechanistic implications
Riccardi D, Cui Q
Journal of Physical Chemistry A, 111(26), 5703, 2007
6 Development of effective quantum mechanical/molecular mechanical (QM/MM) methods for complex biological processes
Riccardi D, Schaefer P, Yang Y, Yu HB, Ghosh N, Prat-Resina X, Konig P, Li GH, Xu DG, Guo H, Elstner M, Cui Q
Journal of Physical Chemistry B, 110(13), 6458, 2006
7 "Proton holes" in long-range proton transfer reactions in solution and enzymes: A theoretical analysis
Riccardi D, Konig P, Prat-Resina X, Yu HB, Elstner M, Frauenheim T, Cui Q
Journal of the American Chemical Society, 128(50), 16302, 2006
8 pK(a) calculations in solution and proteins with QM/MM free energy perturbation simulations: A quantitative test of QM/MM protocols
Riccardi D, Schaefer P, Cui Q
Journal of Physical Chemistry B, 109(37), 17715, 2005
9 Importance of van der Waals interactions in QM/MM Simulations
Riccardi D, Li GH, Cui Q
Journal of Physical Chemistry B, 108(20), 6467, 2004
10 Human calcium-sensing receptor can be suppressed by antisense sequences
Maldonado-Perez D, Breitwieser GE, Gama L, Elliott AC, Ward DT, Riccardi D
Biochemical and Biophysical Research Communications, 311(3), 610, 2003