Focus on Quality: Validation of Spectrometry Software
May 1st 2005The author continues his discussion of the principles involved in the backup and recovery of electronic records. This installment looks at the written procedures associated with this process for a spectrometer operating in a regulated laboratory.
Theoretical and Experimental Investigation of the Electronic Spectra of Antitumor Compounds
May 1st 2005Time-dependent density functional theory and ZINDO/S methods have been used to compute and analyze the electronic spectra of benzazoles, 2-phenylbenzazoles, and 2-(4-aminophenyl)benzazoles. The observed spectra of the studied antitumor drugs are diffuse and highly solvent-dependent. Spectral analysis of the charge density distributions and relative polarities of the ground and excited states have enabled understanding of the observed solvent effects.