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ORCIDChristian Van Alsenoy
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2010 – 2019
- 2015
[j9]Nicolás Otero
, Christian Van Alsenoy, Claude Pouchan, Panaghiotis Karamanis:
Hirshfeld-based intrinsic polarizability density representations as a tool to analyze molecular polarizability. J. Comput. Chem. 36(24): 1831-1843 (2015)- 2014
- [j8]Kiamars Eskandari, Christian Van Alsenoy:
Hydrogen-hydrogen interaction in planar biphenyl: A theoretical study based on the interacting quantum atoms and Hirshfeld atomic energy partitioning methods. J. Comput. Chem. 35(26): 1883-1889 (2014)
2000 – 2009
- 2008
- [j7]Kanda Nivesanond, Anik Peeters, Dirk Lamoen, Christian Van Alsenoy:
Conformational Analysis of TMC114, a Novel HIV-1 Protease Inhibitor. J. Chem. Inf. Model. 48(1): 99-108 (2008) - 2004
- [j6]Joris van Droogenbroeck, Ben Swerts, Lothar Schäfer, Christian Van Alsenoy:
Solids modeled by ab initio crystal field methods, part 22: The Fock matrix transformed supermolecule model and the structure determination of D-erythronic acid-3, 4-carbonate. J. Comput. Chem. 25(16): 2065-2072 (2004) - 2003
- [j5]Frank De Proft, Ricardo Vivas-Reyes, Anik Peeters, Christian Van Alsenoy, Paul Geerlings:
Hirshfeld partitioning of the electron density: Atomic dipoles and their relation with functional group properties. J. Comput. Chem. 24(4): 463-470 (2003) - [j4]Patrick Bultinck, Ramon Carbó-Dorca, Christian Van Alsenoy:
Quality of Approximate Electron Densities and Internal Consistency of Molecular Alignment Algorithms in Molecular Quantum Similarity. J. Chem. Inf. Comput. Sci. 43(4): 1208-1217 (2003) - 2002
- [j3]Frank De Proft, Christian Van Alsenoy, Anik Peeters, Wilfried Langenaeker, Paul Geerlings:
Atomic charges, dipole moments, and Fukui functions using the Hirshfeld partitioning of the electron density. J. Comput. Chem. 23(12): 1198-1209 (2002)
1990 – 1999
- 1996
- [j2]Guang Wu, Sven Jacobs, M. G. Verbruggen, Albert T. H. Lenstra, Christian Van Alsenoy, Herman J. Geise, Luc van Meervelt:
Phenylene vinylene oligomers studied by theoretical methods: Joint analysis of computational and x-ray results of the configurational isomers of 1, 4-bis[2-(3, 4, 5-trimethoxyphenyl)ethenyl]benzene. J. Comput. Chem. 17(10): 1245-1257 (1996) - [j1]Guang Wu, Sven Jacobs, Albert T. H. Lenstra, Christian Van Alsenoy, Herman J. Geise:
2, 5-Dimethoxy-1, 4-bis[2-(2, 4-dimethoxyphenyl) ethenyl]benzene studied by quantum chemical calculations and single crystal X-ray diffraction. J. Comput. Chem. 17(16): 1820-1835 (1996)
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