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intra_substitutionCS_isomerization should not be its own reverse #64

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merged 1 commit into from
May 12, 2015

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@connie connie commented May 12, 2015

Closes ReactionMechanismGenerator/RMG-Py#382

Also must reorder the tree since the rules are listed
in terms of templates that go

XSRJ;C;YJ

The tree must also obey this order in order for kinetics
to be determined correctly.

We should probably have a database test for this.

Closes ReactionMechanismGenerator/RMG-Py#382

Also must reorder the tree since the rules are listed
in terms of templates that go

XSRJ;C;YJ

The tree must also obey this order in order for kinetics
to be determined correctly.

We should probably have a database test for this.
@rwest rwest merged commit 6ded3d8 into master May 12, 2015
@rwest rwest deleted the fix_intra_substitutionCS_isomerization branch May 12, 2015 21:25
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intra_substitutionCS_isomerization not working
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