| Catenanes: A molecular mechanics analysis of the (C13H26)2 Structure 13-13 D2. | 0 | 0.34 | 2016 |
| An improved theoretical approach to the empirical corrections of density functional theory. | 0 | 0.34 | 2012 |
| Accurate prediction of the enthalpies of formation for xanthophylls. | 0 | 0.34 | 2011 |
| Selenoglycosides in silico: ab initio-derived reparameterization of MM4, conformational analysis using histo-blood group ABH antigens and lectin docking as indication for potential of bioactivity. | 0 | 0.34 | 2010 |
| Conformational analysis of thioglycoside derivatives of histo-blood group ABH antigens using an ab initio-derived reparameterization of MM4: implications for design of non-hydrolysable mimetics. | 2 | 0.44 | 2009 |
| Molecular mechanics (MM4) study of amines. | 1 | 0.35 | 2007 |
| Alcohols, ethers, carbohydrates, and related compounds. IV. Carbohydrates. | 7 | 0.75 | 2003 |
| Molecular mechanics (MM3) calculations on lithium amide compounds. | 0 | 0.34 | 2003 |
| Alcohols, ethers, carbohydrates, and related compounds. I. The MM4 force field for simple compounds. | 13 | 1.20 | 2003 |
| Alcohols, ethers, carbohydrates, and related compounds. III. The 1,2-dimethoxyethane system. | 7 | 0.66 | 2003 |
| Molecular mechanics (MM4) calculations on carbonyl compounds. I-IV - Erratum | 0 | 0.34 | 2003 |
| Alcohols, ethers, carbohydrates, and related compounds. II. The anomeric effect. | 9 | 0.98 | 2003 |
| Molecular mechanics calculations on carbonyl compounds. IV. Heats of formation | 1 | 0.36 | 2001 |
| Molecular mechanics calculations on carbonyl compounds. III. Cycloketones | 1 | 0.36 | 2001 |
| Molecular mechanics (MM4) calculations on carbonyl compounds part I: aldehydes | 0 | 0.34 | 2001 |
| Molecular mechanics calculations on carbonyl compounds. II. Open-chain ketones | 2 | 0.42 | 2001 |
| Molecular polarizabilities and induced dipole moments in molecular mechanics | 12 | 1.54 | 2000 |
| Importance of selecting proper basis set in quantum mechanical studies of potential energy surfaces of carbohydrates | 13 | 1.58 | 1999 |
| Directional hydrogen bonding in the MM3 force field: II | 16 | 1.96 | 1998 |
| MM3(96) parameterization for camptothecin analogs: An ab initio and molecular mechanics study. | 1 | 2.53 | 1997 |
| An improved force field (MM4) for saturated hydrocarbons | 41 | 9.41 | 1996 |
| Molecular mechanics (MM4) calculations on conjugated hydrocarbons | 1 | 0.36 | 1996 |
