Implementation of Nonadditive Intermolecular Potentials by Use of Molecular Dynamics: Development of a Water-Water Potential and Water-Ion Cluster Interactions
- James Caldwell
- Peter A. Kollman
- et al.
- 2002
- JACS
Paper
Publications
378 results at JACS
First Evidence for the Existence of Intramolecular C-H-C Hydrogen Bonds: Carbanions of [1. l]Ferrocenophane, 1 -Methyl[ 1.1 jferrocenophane, and l,12-Dimethyl[l.l]ferrocenophane
- Ulrich T. Mueller- Westerhoff
- Adel Nazzal
- et al.
- 2002
- JACS
PaperStereoselectivity in the Photochemical Cycloelimination of Some Polycyclic Cyclobutanones
- R.D. Miller
- V.Y. Abraitys
- 2002
- JACS
PaperOn the Mechanism of the Prenyltransferase Reaction. Metal Ion Dependent Solvolysis of an Allylic Pyrophosphate
- Joachim Bargon
- 2002
- JACS
PaperA Criterion for zwitterionic intermediates in the photochemistry of 2,5-cyclohexadienones
- John S. Swenton
- Edward Saurborn
- et al.
- 2002
- JACS
PaperInternal Conversion in the Photochemistry of Di- and Triolefins
- R. Srinivasan
- 2002
- JACS
PaperA Nondegenerate Mirror-Image Rearrangement: Semibullvalene in the Solid State
- V. Macho
- R.D. Miller
- et al.
- 2002
- JACS
PaperChemically Induced Dynamic Nuclear Polarization and Substituent Effects in Some Homolytic Aromatic Substitution Reactions
- Joachim Bargon
- 2002
- JACS
PaperFluxional Sigmatropic Rearrangements. A Case for Orbital Symmetry Control in Triphenyl-7-cyclohepta-1,3,5-trienyltin
- R.B. Larrabee
- 2002
- JACS
PaperMercury photosensitized isomerization of 1,5-cycloöctadiene to tricyclo [3.3.0.02,6] Octane
- R. Srinivasan
- 2002
- JACS
Paper