Christian Bartels

According to our database, Christian Bartels authored at least 6 papers between 1997 and 2009.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2009

CHARMM: The biomolecular simulation program.

Bernard R. Brooks, Charles L. Brooks III, Alexander D. MacKerell Jr., Lennart Nilsson, Robert J. Petrella, Benoît Roux, Y. Won, G. Archontis, Christian Bartels, Stefan Boresch, Amedeo Caflisch, Leo S. D. Caves, Qiang Cui, Aaron R. Dinner, Michael Feig, S. Fischer, Jiali Gao, Milan Hodoscek, Wonpil Im, Krzysztof Kuczera, Themis Lazaridis, J. Ma, Victor Ovchinnikov, Emanuele Paci, Richard W. Pastor, C. B. Post, J. Z. Pu, Michael Schaefer, Bruce Tidor, Richard M. Venable, H. Lee Woodcock III, X. Wu, W. Yang, Darrin M. York, Martin Karplus

J. Comput. Chem., 2009

2006

QSAR - How Good Is It in Practice? Comparison of Descriptor Sets on an Unbiased Cross Section of Corporate Data Sets.

Peter Gedeck, Bernhard Rohde, Christian Bartels

J. Chem. Inf. Model., 2006

2005

Absolute free energies of binding of peptide analogs to the HIV-1 protease from molecular dynamics simulations.

Christian Bartels, Armin Widmer, Claus Ehrhardt

J. Comput. Chem., 2005

2001

Effective atom volumes for implicit solvent models: comparison between Voronoi volumes and minimum fluctuation volumes.

Michael Schaefer, Christian Bartels, Fabrice Leclerc, Martin Karplus

J. Comput. Chem., 2001

1997

Multidimensional adaptive umbrella sampling: Applications to main chain and side chain peptide conformations.

Christian Bartels, Martin Karplus

J. Comput. Chem., 1997

GARANT-a general algorithm for resonance assignment of multidimensional nuclear magnetic resonance spectra.

Christian Bartels, Peter Güntert, Martin Billeter, Kurt Wüthrich

J. Comput. Chem., 1997