Perl 6 - the future is here, just unevenly distributed

IRC log for #cdk, 2015-08-09

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All times shown according to UTC.

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14:01 commitbot [cdk] johnmay created feature/mmffcharges (+8 new commits): http://git.io/v3kAS
14:01 commitbot cdk/feature/mmffcharges 44acf89 John May: Representation independant type assignment for nitro groups.
14:01 commitbot cdk/feature/mmffcharges 158beec John May: Internal API additions allow us to pass back which bonds are aromatic by MMFF's model. Ideally we would seperate out the aromaticity to a optional preprocessing step but at the moment the aromaticity needs to be assigned after the initial symbolic types.
14:01 commitbot cdk/feature/mmffcharges 2666d00 John May: Map symbolic types HOCS and HON down to integer type 21. These appear in the validation suite and labelled as *new* in the parameter files but do not appear in the papers.
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14:34 commitbot [cdk] johnmay opened pull request #142: Feature/mmffcharges (master...feature/mmffcharges) http://git.io/v3IkO
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14:38 commitbot [cdk] johnmay force-pushed feature/mmffcharges from 8c75d3d to a5cb8ee: http://git.io/v3Ikb
14:38 commitbot cdk/feature/mmffcharges ed28cec John May: Representation independant type assignment for nitro groups.
14:38 commitbot cdk/feature/mmffcharges 6db171c John May: Internal API additions allow us to pass back which bonds are aromatic by MMFF's model. Ideally we would seperate out the aromaticity to a optional preprocessing step but at the moment the aromaticity needs to be assigned after the initial symbolic types.
14:38 commitbot cdk/feature/mmffcharges 4d8ab01 John May: Map symbolic types HOCS and HON down to integer type 21. These appear in the validation suite and labelled as *new* in the parameter files but do not appear in the papers.
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