![]() | ![]() |
| 2010 | ||
|---|---|---|
| 5 | Maja Parac, Markus Doerr, Christel M. Marian, Walter Thiel: QM/MM calculation of solvent effects on absorption spectra of guanine. Journal of Computational Chemistry 31(1): 90-106 (2010) | |
| 2007 | ||
| 4 | Stephan Raub, Christel M. Marian: Quantum chemical investigation of hydrogen-bond strengths and partition into donor and acceptor contributions. Journal of Computational Chemistry 28(9): 1503-1515 (2007) | |
| 2006 | ||
| 3 | Andreas Kämper, Joannis Apostolakis, Matthias Rarey, Christel M. Marian, Thomas Lengauer: Fully Automated Flexible Docking of Ligands into Flexible Synthetic Receptors Using Forward and Inverse Docking Strategies. Journal of Chemical Information and Modeling 46(2): 903-911 (2006) | |
| 2002 | ||
| 2 | Martin Kleinschmidt, Jörg Tatchen, Christel M. Marian: Spin-orbit coupling of DFT/MRCI wavefunctions: Method, test calculations, and application to thiophene. Journal of Computational Chemistry 23(8): 824-833 (2002) | |
| 1998 | ||
| 1 | Marcus Gastreich, Christel M. Marian: Ab initio prediction of 15N-NMR chemical shift in -boron nitride based on an analysis of connectivities. Journal of Computational Chemistry 19(7): 716-725 (1998) | |
Colors in the list of coauthors
Last update Sun Jun 3 16:06:10 2012 CET by the DBLP Team —
Data released under the ODC-BY 1.0 license — See also our legal information page