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Results 1 - 10 of 15  for Great Falls College MSU

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Quantum topological resolution of catalyst proficiency

Jenkins, Samantha ; Xiao, Chen-Xia ; Xu, Tianlv ; Yin, Dulin ; Kirk, Steven R ; Chass, Gregory A

International Journal of Quantum Chemistry, Jul 15, 2015, Vol.115(14), pp.875-883 [Peer Reviewed Journal]

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Base pairing patterns of DNA base lesion spiroiminodihydantoin: A DFT study

Shukla, Pradeep Kumar ; Mishra, P. C.

International Journal of Quantum Chemistry, Dec 15, 2013, Vol.113(24), p.2600(5) [Peer Reviewed Journal]

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Fluorescent dyes in the context of DNA-binding: The case of Thioflavin T.(Report)

Biancardi, Alessandro ; Biver, Tarita ; Mennucci, Benedetta

International Journal of Quantum Chemistry, April 15, 2017, Vol.117(8), p.n/a(7) [Peer Reviewed Journal]

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Full geometry optimizations of the mixed-valence CaMn4O4X(H2O)4 (X=OH or O) cluster in OEC of PS II: Degree of symmetry breaking of the labile Mn-X-Mn bond revealed by several hybrid DFT calculations

Yamaguchi, K. ; Isobe, H. ; Yamanaka, S. ; Saito, T. ; Kanda, K. ; Shoji, M. ; Umena, Y. ; Kawakami, K. ; Shen, J.-R. ; Kamiya, N. ; Okumura, M.

International Journal of Quantum Chemistry, Feb 15, 2013, Vol.113(4), pp.525-541 [Peer Reviewed Journal]

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Rational design of outer-expanded purine analogues as building blocks of DNA-based nanowires with enhanced electronic properties.(Report)

Liu, Haiying ; Li, Genqin ; Zhao, Peng ; Chen, Gang ; Bu, Yuxiang

International Journal of Quantum Chemistry, July 15, 2014, Vol.114(14), p.911(10) [Peer Reviewed Journal]

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Spin states of (bio)inorganic systems: Successes and pitfalls.(Report)

Swart, Marcel;

International Journal of Quantum Chemistry, Jan, 2013, Vol.113(1), p.(1) [Peer Reviewed Journal]

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First-principles studies on the impact of proton disorder on physical properties of ice.(Report)

Wang, Shaoqing;

International Journal of Quantum Chemistry, March, 2013, Vol.113(5), p.661(6) [Peer Reviewed Journal]

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Discrete charge patterns in a Holstein-SSH DNA lattice.(Report)

Dang, Adamou Koko ; Tabi, Conrad Bertrand ; Ekobena Fouda, Henri Paul ; Kofane, Timoleon Crepin

International Journal of Quantum Chemistry, Jan 5, Vol.115(1), p.34(9) [Peer Reviewed Journal]

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Intermolecular interactions, thermodynamic properties, crystal structure, and detonation performance of HMX/NTO cocrystal explosive

Lin, He ; Zhu, Shun-Guan ; Zhang, Lin ; Peng, Xin-Hua ; Chen, Peng-Yuan ; Li, Hong-Zhen

International Journal of Quantum Chemistry, May 15, 2013, Vol.113(10), pp.1591-1599 [Peer Reviewed Journal]

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Theoretical study on the deglycosylation mechanism of rice BGlu1 [beta]-glucosidase.(Report)

Wang, Jinhu ; Hou, Qianqian ; Sheng, Xiang ; Gao, Jun ; Liu, Yongjun ; Liu, Chengbu;

International Journal of Quantum Chemistry, April, 2013, Vol.113(8), p.1071(5) [Peer Reviewed Journal]

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