Can we get monoisotopic (exact) mass from OB

girke-lab / ChemmineOB

OpenBabel wrapper package for R

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Can we get monoisotopic (exact) mass from OB #4

Closed tgirke closed 10 years ago

khoran commented 10 years ago

added as 'exactMass_OB' function. When this has built on bioc I will add it to ChemmineR.

tgirke commented 10 years ago

Thanks! Sean

sent from my iPhone, please excuse typos

On Mon, Apr 28, 2014 at 10:49 AM, kevin notifications@github.com wrote:

added as 'exactMass_OB' function. When this has built on bioc I will add it to ChemmineR.

— Reply to this email directly or view it on GitHubhttps://github.com/girke-lab/ChemmineOB/issues/4#issuecomment-41590228 .

khoran commented 10 years ago

now also in ChemmineR 2.17.4