User Activity
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Posted
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ticket #1384
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The Chemistry Development Kit
Yes this is possible but please post this in the appropriate place (cdk-user mailing...
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ticket #1384
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The Chemistry Development Kit
Resolved
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Modified
ticket #1384
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The Chemistry Development Kit
Inchi with nonstandard options generates standard InChI in CDK 1.5.14
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Posted
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ticket #1385
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The Chemistry Development Kit
It will be different if there's stereochemistry, it would be possible to make them...
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Posted
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ticket #1385
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The Chemistry Development Kit
BTW martin if you want to fix your example either generate the depiction using SDG...
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Modified
ticket #1385
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The Chemistry Development Kit
nullpointer in circular fingerprinter
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Posted
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ticket #1385
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The Chemistry Development Kit
Fixed - problem was more subtle though: https://github.com/cdk/cdk/pull/259 On 5...
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ticket #1385
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Odd will investigate. BTW we're wanting to move to github for issues.
Personal Data
- Username:
- jwmay
- Joined:
- 2011-01-20 08:55:58
Projects
This is a list of open source software projects that John May is associated with:
- Rhea Last Updated:
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The Chemistry Development Kit Last Updated: