Environmental Effects on Guanine-Thymine Mispair Tautomerization Explored with Quantum Mechanical/Molecular Mechanical Free Energy Simulations

Pengfei Li; Atul Rangadurai; Hashim M. Al-Hashimi; Sharon Hammes-Schiffer

doi:10.1021/jacs.0c03774

Environmental Effects on Guanine-Thymine Mispair Tautomerization Explored with Quantum Mechanical/Molecular Mechanical Free Energy Simulations

Pengfei Li
, Atul Rangadurai
, Hashim M. Al-Hashimi
, Sharon Hammes-Schiffer

Research output: Contribution to journal › Article › peer-review

Original language	English
Pages (from-to)	11183-11191
Number of pages	9
Journal	Chemistry Faculty Research and Publications
Volume	142
Issue number	25
DOIs	https://doi.org/10.1021/jacs.0c03774
State	Published - Jun 24 2020
Externally published	Yes

ASJC Scopus Subject Areas

Catalysis
General Chemistry
Biochemistry
Colloid and Surface Chemistry

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10.1021/jacs.0c03774

Cite this

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title = "Environmental Effects on Guanine-Thymine Mispair Tautomerization Explored with Quantum Mechanical/Molecular Mechanical Free Energy Simulations",

author = "Pengfei Li and Atul Rangadurai and Al-Hashimi, \{Hashim M.\} and Sharon Hammes-Schiffer",

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AU - Al-Hashimi, Hashim M.

AU - Hammes-Schiffer, Sharon

PY - 2020/6/24

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JO - Chemistry Faculty Research and Publications

JF - Chemistry Faculty Research and Publications

IS - 25

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Environmental Effects on Guanine-Thymine Mispair Tautomerization Explored with Quantum Mechanical/Molecular Mechanical Free Energy Simulations

ASJC Scopus Subject Areas

Access to Document

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