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gilleain

Discovered public repositories for gilleain in the GitHub catalog.

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gilleain/test_group

Test code for comparing the Refiner and HuXu equivalence class partition code

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gilleain/moleculegen

Molecule generation code, related to OMG, but using a slightly different algorithm

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gilleain/CDKPDB

A mini-project concerned with improving the CDK's PDB file support for small molecules

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gilleain/sigapp

Signature demo/utility apps that I forgot to put on github

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gilleain/roseforest

A textbook-style sketch of an implementation of a split tree datatype for proteins

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gilleain/generation

Temporary home for the structure generation code, before it becomes properly part of a CDK branch

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gilleain/spectral

a small molecule editor using the cdk that displays the predicted C-NMR spectrum using NMRShiftDB

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gilleain/renderlabs

A meta-project composed of small experimental rendering projects for bio/chem-informatics

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