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56篇 您的检索式:作者名="MacKerell"
    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
2Finite element analysis and simulation of quenching and other heat treatment process 显示文摘Mackerel J 2003Computational Materials Science2003,27,:1
3All-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
4Design of Inhibitors for S100B显示文摘MARKOWITZ J MACKERELL AD CARRIER F 2005Curr Top Med Chem(S1568-0266)2005,5,12:1
5Inhibition requirements of the human apical sodium-dependentbile acid transporter ( hASBT) using aminopiperidine conjugatesof glutamyl-bile acids 显示文摘GONZALEZ PM ACHARYA C MACKERELL AD JR 2009Pharm Res2009,26,7:1
6An 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
7All-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
8All-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
9All-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
10All-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
11All-atom empirical potential for molecular modeling and dynamics studies of proteins and nucleic acids显示文摘MacKerell AD Bashford D Bellott M Dunbrack RL Evanseck JD Field MJ Fischer S GaoJ Guo H Ha S 0,,:1
12Membrane 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
13A search for inhibitors of S100B, a member of the SI00 family of calcium- binding proteins显示文摘Markowitz J MacKerell AD Jr Weber DJ 2007Mini Rev Med Chem2007,7,:1
14All-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
15An 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
16Structure, force, and energy of a double-stranded DNA oligonucleotide under tensile loads显示文摘A. D. MacKerell Jr. Gil U. Lee 1999European Biophysics Journal1999,,5:1
17All-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
18All-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
19CHARMM: the biomolecular simulation program显示文摘Brooks B R Brouks C L Mackerell A D 2009J Cumput Chem2009,30,10:1
20Molecular modeling and dynamics of neuropeptide Y 显示文摘Mackerell AD 1988J CAMD1988,2,:1
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