Dear all,
please see
https://bitbucket.org/kienerj/mdfsimplewebapp/overview
A simple web application for demonstration purposes.
You can download an archive (Windows 64-bit only) that contains a working
version of the application including database (PostgreSQL) and servlet
container (tomcat). No installation needed.
The database has 3 compounds preloaded but you can import your own sd-files
if you wish to do so.
Please see README in the archive. It's very simple you just need to execute
2 batch files to start PostgreSQL and tomcat and then open the supplied
html file. thats it!
Note: tomcat runs on port 8080, so that must be unused on your PC!
Best Regards,
Joos
2013/3/9 Rajarshi Guha <[email protected]>
> Certainly an impressive amount of work in this and sounds interesting, but
> one thing I'd suggest is to have a default option to use an in-memory
> database such as H2 or Derby as the backing db. This would save the hassle
> of installing PostgreSQL and would also let you provide a simple runnable
> demo (say import a few SD files)
>
>
> On Sat, Mar 9, 2013 at 10:50 AM, Joos Kiener <[email protected]> wrote:
>
>> Dear CDK Users,
>>
>> about a year ago I sent following message to this user list:
>>
>> http://www.mail-archive.com/[email protected]/msg02376.html
>>
>> After a long pause I finally managed to continue above work and I believe
>> it is soon ready to be released.
>>
>> *I have created a basic framework that allows quick and easy creation of
>> chemical database applications:*
>>
>> *MoleculeDatabaseFramework is a framework for rapidly creating
>> applications that need to store and search for chemical structures in a
>> relational database. It is based on **Spring-Data
>> Framework<http://www.springsource.org/spring-data>
>> ** and uses the **Chemistry Development
>> Kit<http://sourceforge.net/apps/mediawiki/cdk/index.php?title=Main_Page>
>> ** and **Bingo PostgreSQL
>> Cartridge<http://ggasoftware.com/opensource/bingo/user-manual-postgres>
>> ** for enabling chemistry features.*
>>
>> For detailed information please see the projects main page:
>>
>> https://bitbucket.org/kienerj/moleculedatabaseframework
>>
>> What I'm looking for is
>>
>> - feedback from potential users of this framework (features,
>> usability,...)
>> - "code review" -> eg. suggestions for improvement.
>> - contributors, especially with experience in Unit Testing (current tests
>> are basically all integration tests).
>>
>> I'm doing this as hobby in my spare-time as fun. So you can be frank to
>> following question:
>>
>> Do you think there is actually a need for this? (Or does everyone just
>> buy a commercial solution? Or use ChemAxon in case of university?)
>>
>> Best Regards,
>>
>> Joos
>>
>>
>> ------------------------------------------------------------------------------
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>> _______________________________________________
>> Cdk-user mailing list
>> [email protected]
>> https://lists.sourceforge.net/lists/listinfo/cdk-user
>>
>>
>
>
> --
> Rajarshi Guha | http://blog.rguha.net
> NIH Center for Advancing Translational Science
>
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