All Stories

  1. Experimental and Quantum Chemical Evaluations of Pyridine Oxidation Under Drug Development Stress Test Conditions

    Article • Journal of Pharmaceutical Sciences, December 2015, Elsevier

    Dr Anders Broo

  2. A Qualitative Method for Prediction of Amine Oxidation in Methanol and Water

    Article • Journal of Pharmaceutical Sciences, April 2015, Elsevier

    Dr Anders Broo

  3. Molecule VI: Sulfonimide or Sulfonamide?

    Article • Crystal Growth & Design, August 2014, American Chemical Society (ACS)

    Dr Anders Broo

  4. Calculation of electron transfer rates in proteins

    Article • International Journal of Quantum Chemistry, June 2009, Wiley

    Dr Anders Broo

  5. Use of empirical correction terms in calculating ionization constants

    Article • International Journal of Quantum Chemistry, January 2005, Wiley

    Dr Anders Broo

  6. Theoretical characterization of a multifunctional electrooptical molecular device: Photochemical ring-opening mechanism of indolinospirobenzopyran

    Article • International Journal of Quantum Chemistry, January 2000, Wiley

    Dr Anders Broo

  7. A Theoretical Investigation of the Physical Reason for the Very Different Luminescence Properties of the Two Isomers Adenine and 2-Aminopurine

    Article • The Journal of Physical Chemistry A, January 1998, American Chemical Society (ACS)

    Dr Anders Broo

  8. Assignment of Electronic Transition Moment Directions of Adenine from Linear Dichroism Measurements

    Article • Journal of the American Chemical Society, December 1997, American Chemical Society (ACS)

    Dr Anders Broo

  9. Ab Initio and Semiempirical Calculations of Geometry and Electronic Spectra of Ruthenium Organic Complexes and Modeling of Spectroscopic Changes upon DNA Binding

    Article • Inorganic Chemistry, June 1997, American Chemical Society (ACS)

    Dr Anders Broo

  10. Ab initio MP2 and DFT calculations of geometry and solution tautomerism of purine and some purine derivatives

    Article • Chemical Physics, November 1996, Elsevier

    Dr Anders Broo

  11. Electronic structure of donor-spacer-acceptor molecules of potential interest for molecular electronics. IV. Geometry and device properties of P3CNQ and Q3CNQ

    Article • Chemical Physics, July 1995, Elsevier

    Dr Anders Broo

  12. Connection between Structure, Electronic Spectrum, and Electron-Transfer Properties of Blue Copper Proteins

    Article • The Journal of Physical Chemistry, March 1995, American Chemical Society (ACS)

    Dr Anders Broo

  13. A theoretical investigation of the solution N(7) H ? N(9) H tautomerism of adenine

    Article • International Journal of Quantum Chemistry, February 1995, Wiley

    Dr Anders Broo

  14. The emission spectum of p-N,N-dimethylaminobenzonitrile

    Article • Chemical Physics Letters, September 1994, Elsevier

    Dr Anders Broo

  15. Electron transport through organic molecules with applications to molecular devices

    Article • January 1993, Springer Science + Business Media

    Dr Anders Broo

  16. Characterization and improvements of presumptive molecular switch molecules

    Article • Chemical Physics Letters, August 1992, Elsevier

    Dr Anders Broo

  17. Localization and correlation corrections in electronic interactions through single bonded hydrocarbon spacers

    Article • Chemical Physics, September 1991, Elsevier

    Dr Anders Broo

  18. Electron transfer due to through-bond interactions. Study of aliphatic chains

    Article • Chemical Physics, November 1990, Elsevier

    Dr Anders Broo

  19. Long distance electron transfer

    Article • International Journal of Quantum Chemistry, March 1988, Wiley

    Dr Anders Broo