Activity Landscapes, Information Theory, and Structure - Activity Relationships
Iyer, Preeti, Stumpfe, Dagmar, Vogt, Martin, Bajorath, J., Maggiora, G. M.
Published in Molecular informatics (01.06.2013)
Published in Molecular informatics (01.06.2013)
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Theoretical models for solvation and catalysis in carbonyl addition
Williams, Ian H, Spangler, Dale, Femec, Douglas A, Maggiora, Gerald M, Schowen, Richard L
Published in Journal of the American Chemical Society (01.01.1983)
Published in Journal of the American Chemical Society (01.01.1983)
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Stereoelectronic properties of photosynthetic and related systems. V. Ab initio configuration interaction calculations on the ground and lower excited singlet and triplet states of ethyl chlorophyllide a and ethyl pheophorbide a
Petke, J.D, Maggiora, G.M, Shipman,L, Christoffersen, R.E
Published in Photochemistry and photobiology (01.08.1979)
Published in Photochemistry and photobiology (01.08.1979)
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Stereoelectronic properties of photosynthetic and related systems. VII. Ab initio quantum mechanical characterization of the electronic structure and spectra of chlorophyllide a and bacteriochlorophyllide a cation radicals
Petke, J.D, Maggiora, G.M, Shipman, L.L, Christoffersen, R.E
Published in Photochemistry and photobiology (01.03.1980)
Published in Photochemistry and photobiology (01.03.1980)
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Stereoelectronic properties of photosynthetic and related systems. XI. AB initio quantum mechanical characterization of the electronic structure and spectra of the chlorophyllide a and pheophorbide a anion radicals
Petke, J.D, Maggiora, G.M, Shipman, L.L, Christoffersen, R.E
Published in Photochemistry and photobiology (01.10.1982)
Published in Photochemistry and photobiology (01.10.1982)
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Theoretical characterization of proton-induced spectral shifts in Schiff base porphyrins
Petke, James D, Maggiora, Gerald M
Published in Journal of the American Chemical Society (01.05.1984)
Published in Journal of the American Chemical Society (01.05.1984)
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