Jean-Philip Piquemal

2008
8	EE	Julien Pilmé, Jean-Philip Piquemal: Advancing beyond charge analysis using the electronic localization function: Chemically intuitive distribution of electrostatic moments. Journal of Computational Chemistry 29(9): 1440-1449 (2008)
2007
7	EE	Celine Roux, Nohad Gresh, Lalith E. Perera, Jean-Philip Piquemal, Laurent Salmon: Binding of 5-phospho-D-arabinonohydroxamate and 5-phospho-D-arabinonate inhibitors to zinc phosphomannose isomerase from Candida albicans studied by polarizable molecular mechanics and quantum mechanics. Journal of Computational Chemistry 28(5): 938-957 (2007)
2006
6	EE	Christophe Gourlaouen, Jean-Philip Piquemal, Trond Saue, Olivier Parisel: Revisiting the geometry of nd10 (n+1)s0 [M(H2O)]p+ complexes using four-component relativistic DFT calculations and scalar relativistic correlated CSOV energy decompositions (Mp+ = Cu+, Zn2+, Ag+, Cd2+, Au+, Hg2+). Journal of Computational Chemistry 27(2): 142-156 (2006)
2005
5	EE	Jean-Philip Piquemal, Antonio Marquez, Olivier Parisel, Claude Giessner-Prettre: A CSOV study of the difference between HF and DFT intermolecular interaction energy values: The importance of the charge transfer contribution. Journal of Computational Chemistry 26(10): 1052-1062 (2005)
4	EE	Nohad Gresh, Jean-Philip Piquemal, Morris Krauss: Representation of Zn(II) complexes in polarizable molecular mechanics. Further refinements of the electrostatic and short-range contributions. Comparisons with parallel ab initio computations. Journal of Computational Chemistry 26(11): 1113-1130 (2005)
3	EE	Jens Antony, Jean-Philip Piquemal, Nohad Gresh: Complexes of thiomandelate and captopril mercaptocarboxylate inhibitors to metallo-lactamase by polarizable molecular mechanics. Validation on model binding sites by quantum chemistry. Journal of Computational Chemistry 26(11): 1131-1147 (2005)
2004
2	EE	Jean-Philip Piquemal, Benjamin Williams-Hubbard, Natalie Fey, Robert J. Deeth, Nohad Gresh, Claude Giessner-Prettre: Inclusion of the ligand field contribution in a polarizable molecular mechanics: SIBFA-LF. Journal of Computational Chemistry 25(2): 308 (2004)
2003
1	EE	Jean-Philip Piquemal, Benjamin Williams-Hubbard, Natalie Fey, Robert J. Deeth, Nohad Gresh, Claude Giessner-Prettre: Inclusion of the ligand field contribution in a polarizable molecular mechanics: SIBFA-LF. Journal of Computational Chemistry 24(16): 1963-1970 (2003)

Coauthor Index

1	Jens Antony	[3]
2	Robert J. Deeth	[1] [2]
3	Natalie Fey	[1] [2]
4	Claude Giessner-Prettre	[1] [2] [5]
5	Christophe Gourlaouen	[6]
6	Nohad Gresh	[1] [2] [3] [4] [7]
7	Morris Krauss	[4]
8	Antonio Marquez	[5]
9	Olivier Parisel	[5] [6]
10	Lalith E. Perera	[7]
11	Julien Pilmé	[8]
12	Celine Roux	[7]
13	Laurent Salmon	[7]
14	Trond Saue	[6]
15	Benjamin Williams-Hubbard	[1] [2]

Colors in the list of coauthors