Sian T. Howard

2022- Chemistry University of Birmingham, Birmingham, England, United Kingdom 
Computational Chemistry
"Sian T. Howard"
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Nguyen TH, Howard ST, Hanrahan JR, et al. (2012) Experimental and theoretical charge density distribution in a host-guest system: synthetic terephthaloyl receptor complexed to adipic acid. The Journal of Physical Chemistry. A. 116: 5618-28
HOWARD ST, PLATTS JA, ALDER RW. (2010) ChemInform Abstract: Ab initio Studies of Proton Sponges. Part 2. 1,6-Diazabicyclo(4,4,4) tetradecane. Cheminform. 27: no-no
PLATTS JA, HOWARD ST, WOZNIAK K. (2010) ChemInform Abstract: Ab initio Studies of Proton Sponges: 1,8-Bis(dimethylamino)naphthalene. Cheminform. 26: no-no
Amoroso AJ, Edwards PG, Howard ST, et al. (2009) The synthesis and coordination chemistry of a tris-8-aminoquinoline tripodal ligand Dalton Transactions. 8356-8362
Howard ST, Hibbs DE, Amoroso AJ, et al. (2006) Quantum-Chemical Design of Cryptand-like Ditopic Salt Binders. Journal of Chemical Theory and Computation. 2: 354-63
Waller MP, Howard ST, Platts JA, et al. (2006) Novel properties from experimental charge densities: an application to the zwitterionic neurotransmitter taurine. Chemistry (Weinheim An Der Bergstrasse, Germany). 12: 7603-14
Howard ST, Hibbs DE, Amoroso AJ, et al. (2006) Quantum-chemical design of cryptand-like ditopic salt binders Journal of Chemical Theory and Computation. 2: 354-363
Hibbs DE, Howard ST, Huke JP, et al. (2005) A new orbital-based model for the analysis of experimental molecular charge densities: an application to (Z)-N-methyl-C-phenylnitrone. Physical Chemistry Chemical Physics : Pccp. 7: 1772-8
Nguyen TH, Hibbs DE, Howard ST. (2005) Conformations, energies, and intramolecular hydrogen bonds in dicarboxylic acids: Implications for the design of synthetic dicarboxylic acid receptors Journal of Computational Chemistry. 26: 1233-1241
Hibbs DE, Overgaard J, Howard ST, et al. (2005) Experimental charge density of a potential DHO synthetase inhibitor: Dimethyl-trans-2-oxohexahydro-pyrimidine-4,6-dicarboxylate Organic and Biomolecular Chemistry. 3: 441-447
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