Quantum Mechanical/Molecular Mechanical Molecular Dynamics...

Journal of Physical Chemistry B 2011 / 06 Vol. 115; Iss. 24

Quantum Mechanical/Molecular Mechanical Molecular Dynamics and Free Energy Simulations of the Thiopurine S -Methyltransferase Reaction with 6-Mercaptopurine

Pan, Xiao-Liang, Cui, Feng-Chao, Liu, Jing-Yao
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Volume:
115
Language:
english
Journal:
The Journal of Physical Chemistry B
DOI:
10.1021/jp2027516
Date:
June, 2011
File:
PDF, 3.64 MB
english, 2011
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