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Bio
One of the more recent fields in which Professor Suhai has worked is the field of theoretical biospectroscopy. The use of quantum mechanics to determine the structure of biomolecules and their conformational energies is but one small application. In many cases, one can in addition use classical mechanics force fields to get the same information. Indeed quantum mechanical calculations have been combined with experimental data to parameterize a majority of the currently used molecular mechanics force fields. Where classical mechanics is not useful is in enzymatic reactions involving bond breaking and in predicting, interpreting and understanding the electronic absorption (EA), electronic circular dichroism (ECD), fluorescence, vibrational circular dichroism (VCD) and Raman optical activity (ROA) spectra in a variety of diverse biological environments. The interaction of radiation with matter (biological molecules, complexes and life itself) is fundamental to life processes, and it must be treated quantum mechanically. The review and overview articles by Kukushkin/Jalkanen, Petersen/Bohr and March/Matthai deal with many of the aspects of quantum mechanics which are important in molecular biophysics, molecular biology and molecular medicine.
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Papers共 121 篇Author StatisticsCo-AuthorSimilar Experts
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mag(2012)
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Journal of The American Society for Mass Spectrometryno. 6 (2011): 1032-1039
BMC Bioinformaticsno. Suppl 6 (2009): S6-S6
digital Encyclopedia of Applied Physics (2009)
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