April 8, 2010
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Description of CHEMMOL 1.0
Calculates molecular mass and elemental analysis
CHEMMOL is a freeware program for the calculation of molecular masses and chemical analyses of compounds. It was written with the organic chemist in mind. Thus, apart form (most) of the elements a number of organic functional groups and some protecting groups were added. Likewise, all naturally occuring amino acids were added to the database.
CHEMMOL readily parses input lines like CuSO4.Aq5, H2C=CMe-COOPh, [NEt4].[Cl] and even protected peptides like Ac-Pro-Val-Gly-His-OBn without problems.
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