2003 |
12 | EE | Karl Nicholas Kirschner,
Anita H. Lewin,
J. Phillip Bowen:
Molecular mechanics force-field development for amino acid zwitterions.
Journal of Computational Chemistry 24(1): 111-128 (2003) |
2000 |
11 | EE | Guyan Liang,
Jennifer B. Sorensen,
David Whitmire,
J. Phillip Bowen:
Molecular mechanics (MM3) parameterization for oxocarbenium ions.
Journal of Computational Chemistry 21(5): 329-339 (2000) |
1999 |
10 | EE | Anita H. Lewin,
Jennifer B. Sorensen,
John A. Dustman,
J. Phillip Bowen:
Computational methods for conformational analysis of unsymmetrical 1, 3-diamines: 3-aminotropanes.
Journal of Computational Chemistry 20(13): 1371-1378 (1999) |
1998 |
9 | EE | Joong-Youn Shim,
J. Phillip Bowen:
Molecular mechanics studies of acyl halides: I. Molecular structures and conformational analysis.
Journal of Computational Chemistry 19(12): 1370-1386 (1998) |
8 | EE | Joong-Youn Shim,
J. Phillip Bowen:
Molecular mechanics studies of acyl halides: II. Vibrational spectra.
Journal of Computational Chemistry 19(12): 1387-1401 (1998) |
1997 |
7 | EE | Guyan Liang,
Xiannong Chen,
John A. Dustman,
Anita H. Lewin,
J. Phillip Bowen:
Ab initio calculations and molecular mechanics (MM3) force field development for ammonium and protonated aliphatic amines.
Journal of Computational Chemistry 18(11): 1371-1391 (1997) |
6 | EE | Sean W. Carrigan,
Jenn-Huei Lii,
J. Phillip Bowen:
MM3(96) parameterization for camptothecin analogs: An ab initio and molecular mechanics study.
Journal of Computer-Aided Molecular Design 11(1): 61-70 (1997) |
5 | EE | Sean W. Carrigan,
Peter C. Fox,
Monroe E. Wall,
Mansukh C. Wani,
J. Phillip Bowen:
Comparative molecular field analysis and molecular modeling studies of 20-(S)- camptothecin analogs as inhibitors of DNA topoisomerase I and anticancer/antitumor agents.
Journal of Computer-Aided Molecular Design 11(1): 71-78 (1997) |
1996 |
4 | EE | Georgia B. McGaughey,
Eugene L. Stewart,
J. Phillip Bowen:
Ab initio and molecular mechanics (MM2 and MM3) calculations of positively charged conjugated nitrogen-containing compounds.
Journal of Computational Chemistry 17(12): 1395-1405 (1996) |
3 | EE | Guyan Liang,
Peter C. Fox,
J. Phillip Bowen:
Parameter analysis and refinement toolkit system and its application in MM3 parameterization for phosphine and its derivatives.
Journal of Computational Chemistry 17(8): 940-953 (1996) |
1995 |
2 | | Georgia B. McGaughey,
Eugene L. Stewart,
J. Phillip Bowen:
Ab Initio and Molecular Mechanics /MM2 and MM3) Calculations of Nonconjugated Positively Charged Nitrogen-Containg Compounds.
Journal of Computational Chemistry 16(10): 1250-1260 (1995) |
1994 |
1 | | Guyan Liang,
J. Phillip Bowen,
James A. Bentley:
Molecular Mechanics (MM3) Parameterization of Hydroxylamine and Methyl Derivatives.
Journal of Computational Chemistry 15(8): 866-874 (1994) |