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MASP - A program predicting mass spectra of combinatorial libraries

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Steinbeck,  C.
Department of Bioorganic Chemistry, MPI for Chemical Ecology, Max Planck Society;

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Citation

Steinbeck, C., Berlin, K., & Richert, C. (1997). MASP - A program predicting mass spectra of combinatorial libraries. Journal of Chemical Information and Computer Sciences, 37(3), 449-457. doi:10.1021/ci960160n.


Cite as: http://hdl.handle.net/11858/00-001M-0000-0012-A3C0-A
Abstract
MASP, a program predicting fragmentation-free mass spectra of libraries prepared by combinatorial synthesis, is presented. MASP combines user-defined building blocks with a nonvariable core molecule and calculates isotopically resolved mass spectra. Pea