eTD Explore

Start Over Committee Member James Bernhard Anderson Committee Member Prof Sharon Hammes Schiffer Keyword EVB Keyword Umbrella Integration

Open Access

Author:: Chakravorty, Dhruva Kumar
Title:: HYBRID QUANTUM/CLASSICAL MOLECULAR DYNAMICS SIMULATIONS OF HYDROGEN TRANSFER REACTIONS IN ENZYMES
Graduate Program:: Chemistry
Keywords:: DLPROTEIN
EVB
DHFR
ketosteroid isomerase
KSI
WHAM
Umbrella Integration
hydrogen transfer
File:: Download thesis15-1.pdf
Committee Members:: Prof Sharon Hammes Schiffer, Dissertation Advisor/Co-Advisor
Prof Sharon Hammes Schiffer, Committee Chair/Co-Chair
James Bernhard Anderson, Committee Member
Philip C. Bevilacqua, Committee Member
James David Kubicki, Committee Member

Search