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A.I. Alrawashdeh, M.H. Almatarneh and R.A. Poirier, 2013, “Computational study on the deamination reaction of adenine with OH–/nH2O (n=0,1,2,3) and 3H2O”, Can. J. Chem., in press. K.M. Uddin P.L. Warburton and R.A. Poirier, 2012, “Comparisons of Computational and Experimental Thermochemical Properties of a-Amino Acids”. , J. Phys. Chem. B, 116, 3220-3234. P.-Y. Liu, Y-J. Wu, C.C. Pye, P.D. Thornton, R.A. Poirier and D.J. Burnell, 2012, “Facial selectivity in the Diels-Alder reactions of 2,2-disubstituted cyclopent-4-ene-1,3-dione derivatives and a comptational examination of the facial selectivity of Diels-Alder reactions involving structurally related dienes and dienophiles”, Eur. J. Org. Chem., 6, 1186-1194. M. Altarawneh, A.H. Al-Muhtaseb, M.H, Almatarneh, R.A. Poirier, N.W. Assaf and K.K. Altarawneh, 2011,“Theoretical Investigation into Competing Unimolecular and Bimolecular Reactions Encountered in the Pyrolysis of Acetamide“, 2011, J. Phys. Chem. A, 115, 14092-14099. K.M. Uddin and R.A. Poirier, 2011, “Computational study of the deamination of 8-oxoguanine,” J. Phys. Chem. B, 115(29), 9151-9. A.H. Al-Muhtaseb, M. Altarawneh, M.H. Almatarneh, R.A. Poirier and N.W. Assaf, 2011, “Theoretical study of the unimolecular decomposition of thiophenol”, J. Comput. Chem., 32(12), 2708-15. K.M. Uddin, M.H. Almatarneh, D.M. Shaw and R.A. Poirier, 2011, “Mechanistic study of the deamination reaction of guanine: a computational study”, J. Phys. Chem. A, 115(10), 2065-76. P. L. Warburton, R.A. Poirier and D. Nippard, 2011, “Atoms and Bonds in Molecules from Radial Densities”, J. Phys. Chem. A, 115(5), 852-867. M.A. Halim, D.M. Shaw and R.A. Poirier, 2010, “Medium Effect on the Equilibrium Geometries, Vibrational Frequencies and Solvation Energies of Sulfanilamide”, Journal of Mol. Struct. (THEOCHEM), 960, 63-72. M.B. Burt, A.K. Crane, N. Su, N. Rice and R.A. Poirier, 2010, “Ring-chain equilibria of R-but-3- enoate esters; a quantum mechanical study of ADMET and RCM Pathways”, Can. J. Chem. 88(11). M.S. Staveley, R.A. Poirier and S.D. Bungay, 2009, “An Evaluation of Parallel Numerical Hessian Calculations”, High Performance Computing Symposium (HPCS’09), June 14-17, Kingston, ON, Springer Lecture Notes in Computer Science. A. El-Sherbiny and R.A. Poirier, 2009, “Comprehensive Study of Molecular Numerical Integration”, Can. J. Chem., 87, 1313-1321. C.C. Pye, R.A. Poirier, D.J. Burnell and D. Klapstein, 2009, “An ab initio study of 5,6-disubstituted 1,3-cyclohexadienes”, J. Mol. Struct. (THEOCHEM), 909, 66-74. J.W. Hollett and R.A. Poirier, 2009, “SEST: Simulated Electronic Structure Theory”, J. Chemical Theory and Computation, 5(1), 126-135. J.W. Hollett and R.A. Poirier, 2009, “Interesting properties and applications of the average interparticle distance”, Journal of Molecular Modeling, 15, 739-745. Special Issue of proceedings of the Modeling and Design of Molecular Materials meeting in Piechowice, Poland. Kenneth C. Westaway, Yao-ren Fang, Susanna MacMillar and Olle Matsson, Raymond A. Poirier and Shahidul M. Islam, 2008, “Can incoming nucleophile carbon kinetic isotope effects be used to determine the transition state structure for different SN2 reactions?, J. Phys. Chem. A, accepted July 21, 2008. Mansour H. Almatarneh, Christopher G. Flinn and Raymond A. Poirier, 2008, “Mechanisms for the Deamination Reaction of Cytosine with H2O/OH- and 2H2O/OH-: A Computational Study”, Journal of Chemical Information and Modeling, 48(4), 831-843. Shahidul M. Islam and Raymond A. Poirier, 2008, “Addition reaction of adamantylideneadamantane with Br2 and 2Br2 - A Computational Study”, J. Phys. Chem. A, 112, 152-159. Shahidul M. Islam, Stephanie D. Huelin, Margot Dawe and Raymond A. Poirier, 2008, “A comparison of the Standard 6-31G and Binning-Curtiss Basis Sets for Third Row Elements”, J. Chem. Theory and Comput., 4(1), 86-100. Shahidul M. Islam and Raymond A. Poirier, 2007, “New insights into the bromination reaction for a series of alkenes - A computational study”, J. Phys. Chem. A, 111, 13218-13232. Kenneth C. Westaway, Yao-ren Fang, Susanna MacMillar and Olle Matsson, Raymond A. Poirier and Shahidul M. Islam, 2007, “A New Insight into Using Chlorine Leaving Group and Nucleophile Carbon Kinetic Isotope Effects to Determine Substituent Effects on the Structure of SN2 Transition States”, J. Phys. Chem. A, 111(33), 8110-8120. Shahidul M. Islam, Joshua W. Hollett and Raymond A. Poirier, 2007, “Computational Study of the Reactions of SiH3X (X=H,Cl,Br,I) with HCN”, J. Phys. Chem.A, 111(3), 526-540. Joshua W. Hollett and Raymond A. Poirier, 2007, “An interesting relationship between interelectronic distance and the corresponding coulomb integral”, J. of Theoretical and Computational Chemistry, 6(1), 13-22. Joshua W. Hollett, Aaron Kelly and Raymond A. Poirier, 2006,“Quantum mechanical size and steric hindrance”, J. Phys. Chem. A, 110(51), 13884-13888. Aisha El-Sherbiny and Raymond A. Poirier, 2006, “Fortran 90 Code for Molecular Numerical Integration”, Proceedings of the International Symposium on High Performance Computing Systems and Applications.

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