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Items: 6

1.

Epidemiological Typing of Serratia marcescens Isolates by Whole-Genome Multilocus Sequence Typing.

Rossen JWA, Dombrecht J, Vanfleteren D, De Bruyne K, van Belkum A, Rosema S, Lokate M, Bathoorn E, Reuter S, Grundmann H, Ertel J, Higgins PG, Seifert H.

J Clin Microbiol. 2019 Mar 28;57(4). pii: e01652-18. doi: 10.1128/JCM.01652-18. Print 2019 Apr.

PMID:
30728192
2.

Stockholder projector analysis: a Hilbert-space partitioning of the molecular one-electron density matrix with orthogonal projectors.

Vanfleteren D, Van Neck D, Bultinck P, Ayers PW, Waroquier M.

J Chem Phys. 2012 Jan 7;136(1):014107. doi: 10.1063/1.3673321.

PMID:
22239769
3.

Fast density matrix-based partitioning of the energy over the atoms in a molecule consistent with the Hirshfeld-I partitioning of the electron density.

Vanfleteren D, Ghillemijn D, Van Neck D, Bultinck P, Waroquier M, Ayers PW.

J Comput Chem. 2011 Dec;32(16):3485-96. doi: 10.1002/jcc.21933. Epub 2011 Sep 15.

PMID:
21919019
4.

Communication: Hilbert-space partitioning of the molecular one-electron density matrix with orthogonal projectors.

Vanfleteren D, Van Neck D, Bultinck P, Ayers PW, Waroquier M.

J Chem Phys. 2010 Dec 21;133(23):231103. doi: 10.1063/1.3521493.

PMID:
21186849
5.

Partitioning of the molecular density matrix over atoms and bonds.

Vanfleteren D, Van Neck D, Bultinck P, Ayers PW, Waroquier M.

J Chem Phys. 2010 Apr 28;132(16):164111. doi: 10.1063/1.3394018.

PMID:
20441262
6.

Exact ionization potentials from wavefunction asymptotics: the extended Koopmans' theorem, revisited.

Vanfleteren D, Van Neck D, Ayers PW, Morrison RC, Bultinck P.

J Chem Phys. 2009 May 21;130(19):194104. doi: 10.1063/1.3130044.

PMID:
19466818

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