Hello community,
here is the log from the commit of package ghc-isotope for openSUSE:Factory
checked in at 2017-08-31 20:56:48
Comparing /work/SRC/openSUSE:Factory/ghc-isotope (Old)
and /work/SRC/openSUSE:Factory/.ghc-isotope.new (New)
Package is "ghc-isotope"
Thu Aug 31 20:56:48 2017 rev:2 rq:513408 version:0.5.0.1
Changes:
--- /work/SRC/openSUSE:Factory/ghc-isotope/ghc-isotope.changes 2017-04-11
09:38:30.689459377 +0200
+++ /work/SRC/openSUSE:Factory/.ghc-isotope.new/ghc-isotope.changes
2017-08-31 20:56:49.936307676 +0200
@@ -1,0 +2,5 @@
+Thu Jul 27 14:06:43 UTC 2017 - psim...@suse.com
+
+- Update to version 0.5.0.1.
+
+---
Old:
isotope-0.4.0.0.tar.gz
New:
isotope-0.5.0.1.tar.gz
Other differences:
--
++ ghc-isotope.spec ++
--- /var/tmp/diff_new_pack.PLp2z4/_old 2017-08-31 20:56:50.588216081 +0200
+++ /var/tmp/diff_new_pack.PLp2z4/_new 2017-08-31 20:56:50.596214957 +0200
@@ -19,7 +19,7 @@
%global pkg_name isotope
%bcond_with tests
Name: ghc-%{pkg_name}
-Version:0.4.0.0
+Version:0.5.0.1
Release:0
Summary:Isotopic masses and relative abundances
License:GPL-3.0+
++ isotope-0.4.0.0.tar.gz -> isotope-0.5.0.1.tar.gz ++
diff -urN '--exclude=CVS' '--exclude=.cvsignore' '--exclude=.svn'
'--exclude=.svnignore' old/isotope-0.4.0.0/README.md
new/isotope-0.5.0.1/README.md
--- old/isotope-0.4.0.0/README.md 2017-03-11 09:42:03.0 +0100
+++ new/isotope-0.5.0.1/README.md 2017-04-30 01:08:04.0 +0200
@@ -1,5 +1,5 @@
[](https://travis-ci.org/Michaelt293/isotope)
-[](https://gitter.im/Michaelt293/isotope)
+[](https://gitter.im/Michaelt293/isotope)
@@ -13,6 +13,7 @@
* [ToElementalComposition type class](#elementalcomposition-type-class)
* [Behaviour of ElementalComposition, MolecularFormula, CondensedFormula
and EmpiricalFormula data
types](#behaviour-of-elementalcomposition-molecularformula-condensedformula-and-empiricalformula-data-types)
* [Additional functions accepting an ElementSymbol as
input](#additional-functions-accepting-an-elementsymbol-as-input)
+* [Representing ions in Isotope](#representing-ions-in-isotope)
* [Comparison to other chemistry
libraries](#comparison-to-other-chemistry-libraries)
* [Radium](#radium)
* [Ouch](#ouch)
@@ -108,13 +109,13 @@
### `ToElementalComposition` type class
-`ToElementalComposition` is a superclass of `ToMolecularFormula`,
`ToCondensedFormula` and `ToEmpiricalFormula`. In addition to the
`toElementalComposition` method, the `ToElementalComposition` type class has
three other methods; `monoisotopicMass`, `nominalMass` and `averageMass`.
(`toElementalComposition` is the minimal complete definition.) `ElementSymbol`,
`ElementalComposition`, `MolecularFormula`, `CondensedFormula` and
`EmpiricalFormula` all have instances of `ToElementalComposition`. This
provides a uniform approach to working with elements, elemental compositions,
molecular formulae, condensed formulae and empirical formulae.
+`ToElementalComposition` is a superclass of `ToMolecularFormula`,
`ToCondensedFormula` and `ToEmpiricalFormula`. In addition to the
`toElementalComposition` method, the `ToElementalComposition` type class has
four other methods; `charge`, `monoisotopicMass`, `nominalMass` and
`averageMass`. (`toElementalComposition` and `charge` is the minimal complete
definition.) `ElementSymbol`, `ElementalComposition`, `MolecularFormula`,
`CondensedFormula` and `EmpiricalFormula` all have instances of
`ToElementalComposition`. This provides a uniform approach to working with
elements, elemental compositions, molecular formulae, condensed formulae and
empirical formulae.
```haskell
ghci> nominalMass C
NominalMass {getNominalMass = 12}
ghci> averageMass [mol|CH4|]
AverageMass {getAverageMass = 16.042498912958358}
-ghci> monoisotopicMass [mol|N(CH3)3|]
+ghci> monoisotopicMass [con|N(CH3)3|]
MonoisotopicMass {getMonoisotopicMass = 59.07349929446}
```
@@ -158,6 +159,36 @@
[IsotopicMass {getIsotopicMass = 45.95262772},IsotopicMass {getIsotopicMass =
46.95175879},IsotopicMass {getIsotopicMass = 47.94794198},IsotopicMass
{getIsotopicMass = 48.94786568},IsotopicMass {getIsotopicMass = 49.94478689}]
```
+### Representing ions in Isotope
+
+Ions are represented in `Isotope` using the `Ion` type class. The `Ion` type
class has two methods,
