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Brian W. Hopkins, Ph.D.

Affiliations: 
2006 The University of Mississippi, USA 
Area:
Physical Chemistry
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Gregory S. Tschumper grad student 2006 The University of Mississippi
 (Ab initio studies of intermolecular interactions: Hydrogen bonding, van der Waals interactions, and the multicentered approach to integrated quantum mechanical calculations.)

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Publications

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Elsohly AM, Hopkins BW, Copeland KL, et al. (2009) Anchoring the potential energy surface of the diacetylene dimer Molecular Physics. 107: 923-928
Hopkins BW, Elsohly AM, Tschumper GS. (2007) Reliable structures and energetics for two new delocalized pi...pi prototypes: cyanogen dimer and diacetylene dimer. Physical Chemistry Chemical Physics : Pccp. 9: 1550-8
Hopkins BW, ElSohly AM, Tschumper GS. (2007) Reliable structures and energetics for two new delocalized π⋯π prototypes: Cyanogen dimer and diacetylene dimer Physical Chemistry Chemical Physics. 9: 1550-1558
Anderson JA, Hopkins BW, Chapman JL, et al. (2006) A systematic assessment of density functionals and ONIOM schemes for the study of hydrogen bonding between water and the side chains of serine, threonine, asparagine, and glutamine Journal of Molecular Structure: Theochem. 771: 65-71
Hopkins BW, Tschumper GS. (2005) Multicentred QM/QM methods for overlapping model systems Molecular Physics. 103: 309-315
Hopkins BW, Tschumper GS. (2005) Integrated quantum mechanical approaches for extended π systems: Multicentered QM/QM studies of the cyanogen and diacetylene trimers Chemical Physics Letters. 407: 362-367
Hopkins BW, Tschumper GS. (2004) Ab Initio Studies of π⋯π Interactions: The Effects of Quadruple Excitations Journal of Physical Chemistry A. 108: 2941-2948
Hopkins BW, Tschumper GS. (2004) Extending the ONIOM Integrated MO/MO Approach to Hydrogen Bonding in Biologic Systems: Serine-Water and Threonine-Water Dimers International Journal of Quantum Chemistry. 96: 294-302
Hopkins BW, Tschumper GS. (2003) A multicentered approach to integrated QM/QM calculations. Applications to multiply hydrogen bonded systems. Journal of Computational Chemistry. 24: 1563-8
Hopkins BW, Tschumper GS. (2003) A multicentered approach to integrated QM/QM calculations. Applications to multiply hydrogen bonded systems Journal of Computational Chemistry. 24: 1563-1568
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