Michel Petitjean

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PockDrug: A Model for Predicting Pocket Druggability That Overcomes Pocket Estimation Uncertainties

Henri Xhaard, Anne-Claude Camproux, Leslie Regad, 2015, J. Chem. Inf. Model..

Michel Petitjean, M. Petitjean, 2020, Optim. Lett..

Spheres Unions and Intersections and Some of their Applications in Molecular Modeling

Michel Petitjean, M. Petitjean, 2013, Distance Geometry.

A Fast Algorithm to Compute Conical Pockets in Proteins. Application to the Structural Characterization of γ‐Carbonic Anhydrases

Michel Petitjean, M. Petitjean, 2017, Molecular informatics.

VIRAPOPS2 supports the influenza virus reassortments

Michel Petitjean, Anne Vanet, A. Vanet, 2014, Source Code for Biology and Medicine.

Ligand scaffold hopping combining 3D maximal substructure search and molecular similarity

Pierre Tufféry, Olivier Sperandio, Michel Petitjean, 2009, BMC Bioinformatics.

Interactive Maximal Common 3D Substructure Searching with the Combined SDM/RMS Algorithm

Michel Petitjean, M. Petitjean, 1998, Comput. Chem..

Agrégation des similarités : une solution oubliée

Michel Petitjean, Michel Petitjean, 2002, RAIRO Oper. Res..

Three-Dimensional Pattern Recognition from Molecular Distance Minimization

Michel Petitjean, M. Petitjean, 1996, J. Chem. Inf. Comput. Sci..

Comment on "The Extent of the Relationship between the Graph-Theoretical and the Geometric Shape Coefficients of Chemical Compounds"

Michel Petitjean, 1995, J. Chem. Inf. Comput. Sci..

Cavity Versus Ligand Shape Descriptors: Application to Urokinase Binding Pockets

Anne-Claude Camproux, Leslie Regad, Michel Petitjean, 2017, J. Comput. Biol..

Topological statistics on a large structural file

Michel Petitjean, Jacques-Emile Dubois, 1990, J. Chem. Inf. Comput. Sci..

Statistical analysis of atom topological neighborhoods and multivariate representations of a large chemical file

Michel Petitjean, Roger Attias, 1993, J. Chem. Inf. Comput. Sci..

PockDrug-Server: a new web server for predicting pocket druggability on holo and apo proteins

Anne-Claude Camproux, Leslie Regad, Alexandre Borrel, 2015, Nucleic Acids Res..

Four Major Channels Detected in the Cytochrome P450 3A4: A Step toward Understanding Its Multispecificity

Michel Petitjean, Gautier Moroy, François Maurel, 2019, International journal of molecular sciences.

Editor-in-Chief's Report

Michel Petitjean, 2006, Entropy.

Assessing the Geometric Diversity of Cytochrome P450 Ligand Conformers by Hierarchical Clustering with a Stop Criterion

Michel Petitjean, Jamel Meslamani, François André, 2009, J. Chem. Inf. Model..

On the analytical calculation of van der Waals surfaces and volumes: Some numerical aspects

Michel Petitjean, M. Petitjean, 1994, J. Comput. Chem..

VIRAPOPS: a forward simulator dedicated to rapidly evolved viral populations

Michel Petitjean, Anne Vanet, 2014, Bioinform..

Ring Perception: Proof of a Formula Calculating the Number of the Smallest Rings in Connected Graphs

Michel Petitjean, Annick Panaye, Bo Tao Fan, 2000, J. Chem. Inf. Comput. Sci..

Global vision of druggability issues: applications and perspectives.

Anne-Claude Camproux, Michel Petitjean, Colette Geneix, 2017, Drug discovery today.

The FIS2005 Conference in Paris

Michel Petitjean, 2005, Entropy.

wwLigCSRre: a 3D ligand-based server for hit identification and optimization

Pierre Tufféry, Olivier Sperandio, Michel Petitjean, 2009, Nucleic Acids Res..

Applications of the radius-diameter diagram to the classification of topological and geometrical shapes of chemical compounds

Michel Petitjean, M. Petitjean, 1992, J. Chem. Inf. Comput. Sci..

MolDiA: A Novel Molecular Diversity Analysis Tool, 1. Principles and Architecture

Michel Petitjean, Jean-Pierre Doucet, Bo Tao Fan, 2007, J. Chem. Inf. Model..

Computing cavities, channels, pores and pockets in proteins from non-spherical ligands models

Michel Petitjean, Mohamed Benyettou, Pridi Siregar, 2014, Bioinform..

Chirality and Symmetry Measures: A Transdisciplinary Review

Michel Petitjean, M. Petitjean, 2003, Entropy.

Geometric molecular similarity from volume‐based distance minimization: Application to saxitoxin and tetrodotoxin

Michel Petitjean, M. Petitjean, 1995, J. Comput. Chem..

A non-parametric method to compute protein–protein and protein–ligands interfaces. Application to HIV-2 protease–inhibitors complexes

Anne-Claude Camproux, Leslie Regad, Michel Petitjean, 2018, bioRxiv.

Symmetry Through the Eyes of a Chemist, 2nd ed. By István Hargittai and Magdolna Hargittai. Plenum Press: New York, 1995, 469 + xii pp, ISBN 0-306-44851-3

Michel Petitjean, 1996, J. Chem. Inf. Comput. Sci..

About the algebraic solutions of smallest enclosing cylinders problems

Michel Petitjean, M. Petitjean, 2010, Applicable Algebra in Engineering, Communication and Computing.

Using XML for structuring the chemical information: Towards a chemical knowledge representation

Michel Petitjean, Bo Tao Fan, Ana G. Maldonado, 2005 .

Chirality in Geometric Algebra

Michel Petitjean, M. Petitjean, 2021, Mathematics.

Symmetry, Antisymmetry, and Chirality: Use and Misuse of Terminology

Michel Petitjean, M. Petitjean, 2021, Symmetry.

CoMPARA: Collaborative Modeling Project for Androgen Receptor Activity

Ruili Huang, Scott Boyer, Xin Hu, 2020, Environmental health perspectives.

MASSIS: A Mass Spectrum Simulation System. 2: Procedures and Performance

Michel Petitjean, Jean-Pierre Doucet, Annick Panaye, 2003, European journal of mass spectrometry.

Solving the Geometric Docking Problem for Planar and Spatial Sets

Michel Petitjean, BioChem Press, BioChem Press, 2002 .

Michel Petitjean, M. Petitjean, 2004 .

Synthetic lethals in HIV: ways to avoid drug resistance

Michel Petitjean, Anne Vanet, R. Veitia, 2015, Biology Direct.

Insight into the Bioactivity and Metabolism of Human Glucagon Receptor Antagonists from 3D‐QSAR Analyses

Michel Petitjean, Jean-Pierre Doucet, Annick Panaye, 2004 .

On the root mean square quantitative chirality and quantitative symmetry measures

Michel Petitjean, M. Petitjean, 1999 .

New Strategy of Mass Spectrum Simulation Based on Reduced and Concentrated Knowledge Databases

Michel Petitjean, Jean-Pierre Doucet, Annick Panaye, 2005 .