David A. Evans
Affiliations: | 2000-2004 | Chemistry | University of Cambridge, Cambridge, England, United Kingdom |
| 2004-2006 | Spirogen | ||
| 2006- | Eli Lilly, Indianapolis, IN, United States |
Area:
computational chemistryGoogle:
"David Evans"Parents
Sign in to add mentor| David J. Wales | grad student | 2000-2004 | |
| Stephen Neidle | post-doc | 2004-2005 | UCL |
BETA: Related publications
See more...
Publications
|
You can help our author matching system! If you notice any publications incorrectly attributed to this author, please sign in and mark matches as correct or incorrect. |
| Evans DA, Neidle S. (2006) Virtual screening of DNA minor groove binders. Journal of Medicinal Chemistry. 49: 4232-8 |
| Campbell NH, Evans DA, Lee MP, et al. (2006) Targeting the DNA minor groove with fused ring dicationic compounds: comparison of in silico screening and a high-resolution crystal structure. Bioorganic & Medicinal Chemistry Letters. 16: 15-9 |
| Agbo JK, Leitner DM, Evans DA, et al. (2005) Influence of vibrational energy flow on isomerization of flexible molecules: incorporating non-Rice-Ramsperger-Kassel-Marcus kinetics in the simulation of dipeptide isomerization. The Journal of Chemical Physics. 123: 124304 |
| Evans DA, Wales DJ, Dian BC, et al. (2004) The dynamics of conformational isomerization in flexible biomolecules. II. Simulating isomerizations in a supersonic free jet with master equation dynamics. The Journal of Chemical Physics. 120: 148-57 |
| Evans DA, Wales DJ. (2004) Folding of the GB1 hairpin peptide from discrete path sampling. The Journal of Chemical Physics. 121: 1080-90 |
| Evans DA, Wales DJ. (2003) The free energy landscape and dynamics of met-enkephalin Journal of Chemical Physics. 119: 9947-9955 |
| Evans DA, Wales DJ. (2003) Free energy landscapes of model peptides and proteins The Journal of Chemical Physics. 118: 3891-3897 |
| Dian BC, Longarte A, Mercier S, et al. (2002) The infrared and ultraviolet spectra of single conformations of methyl-capped dipeptides: N-acetyl tryptophan amide and N-acetyl tryptophan methyl amide Journal of Chemical Physics. 117: 10688-10702 |
| Mortenson PN, Evans DA, Wales DJ. (2002) Energy landscapes of model polyalanines The Journal of Chemical Physics. 117: 1363-1376 |