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Hi Kevin,
Something seems to be broken with probOB() in the current release of R-3.0.2 and Bioc 2.13. When
I run it then the result contains many empty columns. For instance:
> library(ChemmineR)
>…
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I'm still getting feedback that scientists are unclear how to find more info about the project from the landing page. I think the structure is right, and that the status needs to be clearly described …
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overflow-x: auto in the css meant for tables is the culprit. Maybe the metadata table cells can be force-wrapped or given a max-width.
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Guess what, my newly formed InChI strings are now too long. I'm not sure why I didn't get this problem with the SQLite table, presumably because it doesn't do this like MySQL does, but here's what ha…
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Hi there,
One of the functionality of our software is to cache chemical metadata. We have at the moment something like 60 million chemicals, however they're not stored on redis. Redis in this case is…
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**[Original report](https://bitbucket.org/dan2097/opsin/issue/1) by Anonymous.**
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I've tried several names. InChI and CML look good, but the web page seems t…
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we want sql LIKE fir string comparisons, especially for the species (inchi).
this is unimplemented in our sql parser.
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When a molecule has > 99 bonds, the number of atoms and bonds in the .mol file can run together:
Consider the following C70 molecule with 105 bonds (InChI=1/C70/c1-2-22-5-6-24-13-14-26-11-9-23-4-3(21(…