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42篇 您的检索式:作者名="MACKERELL A"
    题名 作者 年代 出处 被引量
1Empirical force fields for biological macromolecules:overview and issues显示文摘Mackerell A D 0,,:1
2All-atom empirical potential for molecular mode lingand dy- namics studies of proteins显示文摘MACKERELL A D BASHFORD J D BELLOTT M 1998J Phys Chem B1998,102,18:1
3An All-atom Empirical Energy Function for the Simulation of Nucleic Acids显示文摘 Wiorkiewiczkuczera J Karplus M 1995J Am Chem Soc1995,117,11:1
4All-atom empirical potential for molecular modeling and dynamics studies of proteins显示文摘MacKerell A D Bashford D Bellott M 1998J Phys Chem B1998,102,18:1
5All-atom empirical force field for nucleic acids: 1) Parameter optimization based on small molecule and condensed phase macro molecular target data显示文摘Foloppe N MacKerell Jr A D 2000Journal of Computational Chemistry2000,21,:1
6All-atom empirical potential for molecular modeling and dynamics studies of proteins显示文摘MACKERELL A BASHFORD D BELLOTT M 1998J Phys Chem B1998,102,:1
7All-atom empirical potential for molecular modeling and dynamics studies of proteins显示文摘MacKerell A D Bashford D Bellott M 1998Journal of Physical Chemistry B1998,102,18:1
8Membrane integrity and oxidative properties of mitochondria isolated from imbibing pea seeds after priming or accelerated ageing 显示文摘Benamar A Tallon C Mackerel D 2003Seed Sci- ence Research2003,13,1:1
9All-atom empirical potential for molecular modeling and dynamics studies of proteins显示文摘MacKerell A D Jr Bashford D Bellott M 1998J Phys Chem B1998,102,18:1
10An ab initio quantum mechanical study of hydrogen-bonded complexes of biological interes显示文摘HUANG N MACKERELL Jr A D 2002J Phys Chem A2002,106,:1
11All-atom empirical potential for molecular modeling anddynamics studies of proteins 显示文摘MACKERELL A D JR BASHFORD D BELLOTT M 1998J Phys Chem B1998,102,:1
12All-atom empirical potential for molecular modeling and dynamics stud- ies of proteins显示文摘MACKERELL A D BASHFORD D BELLOTT M 1998J Phys Chem B1998,102,:1
13CHARMM: the biomolecular simulation program显示文摘Brooks B R Brouks C L Mackerell A D 2009J Cumput Chem2009,30,10:1
14All-atom Empirical Potential for Molecular Modeling and Dynamics Studies of Proteins显示文摘MacKerell A D Bashford D Bellott M 1998J Phys Chem B1998,102,18:1
15All-atom empirical potential for molecular modeling and dynamics studies of proteins显示文摘MacKerell A D Bashford D Bellott M Dunbrack R L Evanseck J D Field M J Fischer S Gao J Guo H Ha S Joseph-McCarthy D Kuchnir L Kuczera K Lau F T K Mattos C Michnick S Ngo T Nguyen D T Prodhom B Reiher W E Roux B Schlenkrich M Smith J C Stote R Straub J Watanabe M Wiorkiewicz-Kuczera J Yin D and Karplus M 1998Journal of Physical Chemistry B1998,102,18:1
16Atomistic simulation study of linear alkylbenzene sulfonates at the water/air interface显示文摘HE X GUVENCH O MACKERELL A D 2010Journal of Physical Chemistry B2010,114,30:1
17III, Extending the treatment of backbone energetics in protein force fields: limitations of gas-phase quantum mechanics in reproducing protein conformational distributions in molecular dynamics simulations显示文摘MacKerell A D Jr Feig M Brooks C L 2004Journal of Computational Chemistry2004,25,:1
18查看详情显示文摘MACKERELL A D BASHFORD D BELLOTT M 0,,:1
19Atom- istic simulation study of linear alkylbenzene suffonates at the water/air interface显示文摘HE X GUVENCH O MACKERELL A D 2010Journal of Physical Chemis- try B2010,114,30:1
20All-atom empirical potential for molecular modeling and dy- namics studies of proteins 显示文摘Mackerell Jr A D Bashford M D Dunbrack Jr R L 1998J Phys Chem B1998,102,18:1
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