An open Java Simulation Kernel for Molecular Fragment Dissipative Particle Dynamics

Ertl algorithm for automated functional groups detection and extraction of organic molecules implemented on the basis of the Chemistry Development Kit (CDK)

Ertl algorithm for automated functional groups detection and extraction of organic molecules implemented on the basis of the Chemistry Development Kit (CDK)

The algorithm for automated functional groups detection and extraction of organic molecules developed by Peter Ertl is implemented on the basis of the Chemistry Development Kit (CDK). Folder Basic contains the basic ErtlFunctionalGroupsFinder code and test code for integration in Java projects. Folder CDK contains CDK library jar file cdk-2.2.jar that ErtlFunctionalGroupsFinder works with. Folder Evaluation contains sample code for evaluation of functional groups with ErtlFunctionalGroupsFinder. Folder JUnit 4 contains library jar files for unit testing. Folder Performance contains a jar library for performance tests. ErtlFunctionalGroupsFinder is described in the scientific literature

Rezension zu Tooze, J. Adam: Crashed. Wie zehn Jahre Finanzkrise die Welt verändert haben, Bonn: Bundeszentrale für politische Bildung, 2019 ISBN 978-3-7425-0317-6