Description Usage Arguments Value Author(s) Examples
Computes the exact mass of each compound given.
1 | exactMassOB(sdfset)
|
sdfset |
Any SDFset object. |
A vector of mass values.
Kevin Horan
1 2 3 | library(ChemmineR)
data(sdfsample)
mass = exactMassOB(sdfsample)
|
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