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mspire-molecular_formula 0.1.0

mspire library to handle molecular formulas (including an optional charge state), complete with relevant chemical properties such as mass, m/z, and isotope distribution.

Gemfile:
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install:
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Versions:

  1. 0.1.0 - August 03, 2014 (15 KB)
  2. 0.0.1 - August 02, 2014 (14 KB)

Runtime Dependencies (1):

mspire-mass ~> 0.1.0

Development Dependencies (6):

bundler ~> 1.6.2
fftw3 ~> 0.3
rake >= 0
rdoc ~> 4.1.1
rspec ~> 2.14.1
simplecov ~> 0.8.2

Owners:

Authors:

  • John T. Prince

SHA 256 checksum:

fd69ef6d4d5a7c6f4bf66321bef91619992212b5a31bc4c77a8fb5517b20b8b6

Total downloads 5,670

For this version 3,316

License:

MIT

Required Ruby Version: >= 0

Links: