Daniel P Vercauteren - Citegraph

Author Info

Name	Affiliation	Papers
DANIEL P VERCAUTEREN	Facultés Universitaires Notre-Dame de la Paix (FUNDP) Laboratoire de Physico-Chimie Informatique (PCI) Rue de Bruxelles 61 B-5000 Namur Belgium	18
Collaborators	Citations	PageRank
26	15	6.86
Referers	Referees	References
30	250	101

Search Limit

100250

Publications (18 rows)

Collaborators (26 rows)

Referers (30 rows)

Referees (100 rows)

Title	Citations	PageRank	Year
Investigating cyclic peptides inhibiting CD2–CD58 interactions through molecular dynamics and molecular docking methods	0	0.34	2018
Charge density distributions derived from smoothed electrostatic potential functions: design of protein reduced point charge models.	0	0.34	2011
Ion-exchanged binuclear Ca2OX clusters, X = 1-4, as active sites of selective oxidation over MOR and FAU zeolites.	0	0.34	2010
Can Descriptors of the Electron Density Distribution Help To Distinguish Functional Groups?	0	0.34	2008
Collective motions in protein structures: Applications of elastic network models built from electron density distributions	0	0.34	2008
Collective motions of rigid fragments in protein structures from smoothed electron density distributions.	1	0.36	2008
Electric field convergence versus atomic basis sets in all-siliceous zeolites.	2	0.58	2008
Quick scheme for evaluation of atomic charges in arbitrary aluminophosphate sieves on the basis of electron densities calculated with DFT methods.	2	0.58	2007
Influence of conformation on the representation of small flexible molecules at low resolution: alignment of endothiapepsin ligands.	1	0.35	2005
Use of Electron Density Critical Points as Chemical Function-Based Reduced Representations of Pharmacological Ligands.	2	0.36	2004
Application of a Kohonen Neural Network to the Analysis of Data Regarding the Alkylation of Toluene with Methanol Catalyzed by ZSM-5Type Zeolites	0	0.34	2002
A new graph descriptor for molecules containing cycles. Application as screening criterion for searching molecular structures within large databases of organic compounds.	5	0.49	2001
Critical Point Representations of Electron Density Maps for the Comparison of Benzodiazepine-Type Ligands.	1	0.35	2000
Determination of Screening Descriptors for Chemical Reaction Databases	0	0.34	2000
Similarity and complementarity of molecular shapes: applicability of a topological analysis approach.	1	0.39	1996
Shape information from a critical point analysis of calculated electron density maps: application to DNA-drug systems.	0	0.34	1994
Study of the water behavior into a ferrierite zeolite by molecular dynamics simulations	0	0.34	1991
Structural requirements of Na+-dependent antidopaminergic agents: Tropapride, Piquindone, Zetidoline, and Metoclopramide. Comparison with Na+-independent ligands.	0	0.34	1989

1