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NMR chemical shielding surface of N-Acetyl-N-Methylalaninamide: A density functional study., , , , , and . J. Comput. Chem., 18 (1): 126-138 (1997)Is the Stereomutation of Methane Possible?, , , , , and . J. Comput. Chem., 16 (2): 207-225 (1995)An appreciation.. J. Comput. Chem., 22 (13): 9-11 (2001)Theoretical Investigation of the Relative Stabilites of XSSX and X2SS Isomers (X=F, C1, H, and CH3., , and . J. Comput. Chem., 16 (4): 465-477 (1995)Ab initio study of the formation of C3H3+ from the reaction of CH3+ with acetylene., , , and . J. Comput. Chem., 17 (7): 905-909 (1996)Editorial., and . J. Comput. Chem., 14 (1): 1 (1993)Ab initio models for multiple-hydrogen exchange: Comparison of cyclic four- and six-center systems., , and . J. Comput. Chem., 14 (10): 1149-1163 (1993)Molecular mechanics and ab initio calculations on cyclopentadienyl cations., and . J. Comput. Chem., 19 (12): 1402-1420 (1998)Ab initio calculations on phosphorus compounds. II. Effects of disubstitution on ligand apicophilicity in phosphoranes., , , , and . J. Comput. Chem., 14 (5): 522-529 (1993)Bay-type H···H "bonding" in cis-2-butene and related species: QTAIM versus NBO description., , and . J. Comput. Chem., 35 (20): 1499-1508 (2014)