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Mechanical force used to explore thermally disallowed chemical reactions.

 

Biaising Reaction Pathways with Mechanical Force

C. R. Hickenboth, J.S. Moore, S.R. White, N. R. Sottos, J. Baudry, and S.R. Wilson

 Nature, (2007) 446:423-427

 

This work in context: Autonomic Healing Research at UIUC and Self-healing polymers in Jeffrey S. Moore’s lab. 


 

First systematic description of a large integrated system: the purple membrane.

Molecular Dynamics Study of Bacteriorhodopsin and the Purple Membrane

J. Baudry, E. Tajkhorshid, F. Molnar, J. Phillips and K. Schulten,

J. Phys. Chem. B. Feature Article (2001) 105(5):905-918

 

This work in context: Purple Membrane page in Klaus Schulten's lab.


 

 

Discovery of a new P450’s function and substrates through modeling:

 

A Retinoic Acid Binding Cytochrome P450: CYP120A1 from Synechocystis sp. PCC 6803

N. Ke, J. Baudry, T. Makris, M. A. Schuler and S. G.Sligar

Arch. Biochem. Biophys. (2005) 436:110-120

 

This work in context: P450 structure and function in Mary Schuler's lab.




Method development to improve P450 modeling:

 

Class-Dependent Sequence Alignment Strategy Improves the Structural and Functional Modeling of P450s.

J. Baudry, S. Rupasinghe, and M. Schuler

Protein Eng. Des. Sel. (2006) 19(8):345–353

This work in context: P450 structure and function in Mary Schuler's lab.





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