chem-bla-ics
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  • Apr 2, 2010

    New Blue Obelisk Exchange online at Shapado.com

    StackOverflow has served as very well in the past couple of months with the Blue Obelisk Exchange. The BOx was taking advantage of a beta project of StackOverflow, and users of that program can switch to a payed plan after the beta phase was over. That moment is nearing, but the pricing model is just unrealistic for us. There were also some comments on the Blue Obelisk using proprietary software (see Stackoverflow not open source — not a problem?).

    less than 1 minute read
  • Apr 1, 2010

    OpenTox Virtual Seminar, Thursday April 1, 11.00 CEST

    Today I gave a presentation of my research, the CDK, Bioclipse, and recent RDF work:

    less than 1 minute read
  • Mar 30, 2010

    Cleaner CDK Code #4: inheriting JavaDoc from super classes and interfaces

    When you write a class implementing an interface or extending a super class, it is often the case that the API is identical. It would be nice to inherit the JavaDoc documentation, which is possible.

    less than 1 minute read
  • Mar 29, 2010

    ACS Boston: RDF Symposium update

    The deadline for abstract submission for the ACS symposium on Semantic Chemistry with the Resource Description Framework has passed. Eleven independent abstracts made the deadline. Here’s what you can expect in Boston:

    less than 1 minute read
  • Mar 29, 2010

    CDK-Taverna paper published

    It took a while, but the CDK-Taverna paper (doi:10.1186/1471-2105-11-159) which has been in preparation for a while in the CDK subversion repository, is now published. Christoph already wrote up a brief explanation in his blog:

    1 minute read
  • Mar 27, 2010

    Updated my blog template

    I noted today that blogger.com, the blog service provider I am using, had new templates. I was getting tired of the old one anyway, so tried the simple template using the usual orange: quite satisfactory! At least, beats buying a book like this Blogger: Beyond the Basics. Don’t have time for that.

    1 minute read
  • Mar 26, 2010

    Cleaner CDK Code #3: run the PMD tests

    PMD is a tool to run some tests against your source code. The check for code style, common problems, and places where code could be improved. The CDK has been using it for years now, such as here for CDK 1.3.x.

    less than 1 minute read
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  • Egon Willighagen
  • 0000-0001-7542-0286

Chemblaics (pronounced chem-bla-ics) is the science that uses open science and computers to solve problems in chemistry, biochemistry and related fields.