Quantum chemical calculations of nicotine and caffeine molecule in gas phase and solvent using DFT methods
Author:
Publisher
Elsevier BV
Subject
Multidisciplinary
Reference42 articles.
1. Adolescent caffeine use, ADHD, and cigarette smoking;Leslie;Child Health Care,2010
2. Caffeine's influence on nicotine's effects in nonsmokers;Blank;Am. J. Health Behav.,2007
3. The perspective of caffeine and caffeine derived compounds in therapy;Pohanka;Bratisl. Lek. Listy,2015
4. Measurement of integrated absorption cross-section, oscillator strength and number density of caffeine in coffee beans by integrated absorption coefficient technique;Belay;Food Chem.,2010
5. Metamorphosis of caffeine hydrate and anhydrous caffeine;Edwards;J. Chem. Soc., Perkin Trans.,1997
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