Mathematics Meets Chemistry - Workflow-guided Evolving Software for Molecular Modelling.

Dirk Reith Karl N. Kirschner

Published in: ERCIM News (2012)

Keyphrases

organic chemistry
control flow
data flow
software development
chemical reactions
source code
computer systems
software systems
software architecture
software package
development process
software tools
web services
computer science
software engineering
software packages
chemical reaction
three dimensional