scholarly journals Computational Replication of the Abnormal Secondary Kinetic Isotope Effects in a Hydride Transfer Reaction in Solution with a Motion Assisted H-Tunneling Model

2014 ◽  
Vol 79 (5) ◽  
pp. 1989-1994 ◽  
Author(s):  
Sadra Kashefolgheta ◽  
Mortezaali Razzaghi ◽  
Blake Hammann ◽  
James Eilers ◽  
Daniel Roston ◽  
...  
Keyword(s):  
Transfer Reaction ◽  
Isotope Effects ◽  
Hydride Transfer ◽  
Kinetic Isotope Effects ◽  
Tunneling Model ◽  
Kinetic Isotope ◽  
Hydride Transfer Reaction ◽  
Reaction In Solution

scholarly journals Hydride Transfer in DHFR by Transition Path Sampling, Kinetic Isotope Effects, and Heavy Enzyme Studies

Biochemistry ◽  
2015 ◽  
Vol 55 (1) ◽  
pp. 157-166 ◽  
Author(s):  
Zhen Wang ◽  
Dimitri Antoniou ◽  
Steven D. Schwartz ◽  
Vern L. Schramm
Keyword(s):  
Isotope Effects ◽  
Hydride Transfer ◽  
Kinetic Isotope Effects ◽  
Path Sampling ◽  
Transition Path ◽  
Transition Path Sampling ◽  
Kinetic Isotope
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