Stefan Neumann

Publication Activity (10 Years)

Years Active: 2010-2020
Publications (10 Years): 2

Top Topics

Development Kit

Molecular Dynamics Simulations

Simulation Model

Fully Functional

Top Venues

J. Cheminformatics

Publications

Karina van den Broek, Mirco Daniel, Matthias Epple, Jan-Mathis Hein, Hubert Kuhn, Stefan Neumann, Andreas Truszkowski, Achim Zielesny
MFsim - an open Java all-in-one rich-client simulation environment for mesoscopic simulation. J. Cheminformatics 12 (1) (2020)
Sebastian Fritsch, Stefan Neumann, Jonas Schaub, Christoph Steinbeck, Achim Zielesny
ErtlFunctionalGroupsFinder: automated rule-based functional group detection with the Chemistry Development Kit (CDK). J. Cheminformatics 11 (1) (2019)
Andreas Truszkowski, Mirco Daniel, Hubert Kuhn, Stefan Neumann, Christoph Steinbeck, Achim Zielesny, Matthias Epple
A molecular fragment cheminformatics roadmap for mesoscopic simulation. J. Cheminformatics 6 (1) (2014)
Andreas Truszkowski, Stefan Neumann, Achim Zielesny, Egon L. Willighagen, Christoph Steinbeck
CDK-Taverna 2.0: migration and enhancements of an open-source pipelining solution. J. Cheminformatics 3 (S-1) (2011)
Andreas Truszkowski, Kalai Vanii Jayaseelan, Stefan Neumann, Egon L. Willighagen, Achim Zielesny, Christoph Steinbeck
New developments on the cheminformatics open workflow environment CDK-Taverna. J. Cheminformatics 3 (2011)
Hubert Kuhn, Stefan Neumann, Christoph Steinbeck, Carsten Wittekindt, Achim Zielesny
Molecular fragments chemoinformatics. J. Cheminformatics 2 (S-1) (2010)