David C. Spellmeyer

发表

The effect of workstation technology on methods in drug design and discovery

William C. Swope, David C. Spellmeyer, William Swope, 1993 .

Does Combinatorial Chemistry Obviate Computer-Aided Drug Design?o Reviews in Computational Chemistry

Eric J. Martin, Jeffrey M. Blaney, Roger E. Critchlow, 2007 .

Diverse Approaches to Combinatorial Library Design

Eric J. Martin, Jeffrey M. Blaney, Steven Rosenberg, 1998 .

Artificial Intelligence: Emerging Applications in Biotechnology and Pharma

David C. Spellmeyer, David Sahner, D. Spellmeyer, 2020 .

Simulation of the solvation free energies for methane, ethane, and propane and corresponding amino acid dipeptides : a critical test of the bond-PMF correction, a new set of hydrocarbon parameters, and the gas phase-water hydrophobicity scale

Peter A. Kollman, David A. Pearlman, David C. Spellmeyer, 1992 .

Chapter 28. Recent Developments in Molecular Diversity: Computational Approaches to Combinatorial Chemistry

David C. Spellmeyer, D. Spellmeyer, P. Grootenhuis, 1999 .

Transition structures of pericyclic reactions. Electron correlation and basis set effects on the transition structure and activation energy of the electrocyclization of cyclobutene to butadiene

Kendall N. Houk, David C. Spellmeyer, D. Spellmeyer, 1988 .

Torquoselectivity in the electrocyclic conversion of benzocyclobutenes to o-xylylenes

Gérald Bernardinelli, Kendall N. Houk, Charles W. Jefford, 1992 .

Substituent Effects on Rates and Stereoselectivities of Conrotatory Electrocyclic Reactions of Cyclobutenes. A Theoretical Study.

K. N. Houk, David C. Spellmeyer, E. Adam Kallel, 1996, The Journal of organic chemistry.

Energy component analysis for dilute aqueous solutions of lithium(1+), sodium(1+), fluoride(1-), and chloride(1-) ions

William L. Jorgensen, Jayaraman Chandrasekhar, David C. Spellmeyer, 1984 .

Annual reports in computational chemistry

David A. Dixon, Ralph A. Wheeler, David C. Spellmeyer, 2007 .

Theoretical investigations of the rotational barrier in anisole: an ab initio and molecular dynamics study

Peter A. Kollman, Michael D. Miller, David C. Spellmeyer, 1990 .