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  1. The Chemistry Development Kit ported to .NET Framework

    C# 12 3

  2. Forked from cdk/cdk

    The Chemistry Development Kit

    Java

  3. Chemical formatter for Microsoft Office

    C# 1

  4. NCDK-Excel is Add-in for enabling cheminformatics functions in Excel worksheet.

    C#

  5. PDF concatenation tool

    C# 1

  6. Forked from pfnet-research/chainer-chemistry

    Chainer Chemistry: A Library for Deep Learning in Biology and Chemistry

    Python

282 contributions in the last year

Apr May Jun Jul Aug Sep Oct Nov Dec Jan Feb Mar Apr Mon Wed Fri

Contribution activity

April 2019

Created a pull request in cdk/cdk that received 1 comment

Fix NullPointerException in AtomPairs2DFingerprinter.getBitFingerprint.

It makes both direction for each bond but pathToBit table stores only one direction. If it selects opposite side, it throw NullPointerException. Th…

+14 −1 1 comment

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