Computational Studies of 2-Photon Uncaging
These researchers use the Dalton computation package to predict the 2-photon spectrum of model compounds designed as potential targets for 2-photon uncaging of biologically active drugs. The predictions will be compared with experimental measurements in the laboratories, providing some of the first direct comparisons of computation and experiment for complete 2-photon absorption spectra. This work will support future molecular design of compounds in Professor Mark Distefano's laboratory.
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