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1

Toward in silico structure-based ADMET prediction in drug discovery

Gautier Moroy, Virginie Y. Martiny, Philippe Vayer, Bruno O. Villoutreix, Maria A. Miteva

Journal:

Drug Discovery Today

Year:

2012

Language:

english

File:

PDF, 1.76 MB

english, 2012

2

Transitions between phases of genomic differentiation during stick-insect speciation

Riesch, Rüdiger, Muschick, Moritz, Lindtke, Dorothea, Villoutreix, Romain, Comeault, Aaron A., Farkas, Timothy E., Lucek, Kay, Hellen, Elizabeth, Soria-Carrasco, Víctor, Dennis, Stuart R., de Carvalho

Journal:

Nature Ecology & Evolution

Year:

2017

Language:

english

File:

PDF, 4.35 MB

english, 2017

3

Long-term balancing selection on chromosomal variants associated with crypsis in a stick insect

Lindtke, Dorothea, Lucek, Kay, Soria-Carrasco, Víctor, Villoutreix, Romain, Farkas, Timothy E., Riesch, Rüdiger, Dennis, Stuart R., Gompert, Zach, Nosil, Patrik

Journal:

Molecular Ecology

Year:

2017

Language:

english

File:

PDF, 2.18 MB

english, 2017

4

Virtual screening web servers: designing chemical probes and drug candidates in the cyberspace

Singh, Natesh, Chaput, Ludovic, Villoutreix, Bruno O

Journal:

Briefings in Bioinformatics

Year:

2020

Language:

english

File:

PDF, 608 KB

english, 2020

5

Polymer Melt Rheology at High Shear Rates

Haddout, A., Villoutreix, G.

Journal:

International Polymer Processing Journal of the Polymer Processing Society

Year:

2000

Language:

english

File:

PDF, 160 KB

english, 2000

6

Fast rescoring protocols to improve the performance of structure-based virtual screening performed on protein-protein interfaces

Singh, Natesh, Chaput, Ludovic, Villoutreix, Bruno

Journal:

Journal of Chemical Information and Modeling

Year:

2020

File:

PDF, 24.33 MB

2020

7

Free Resources to Assist Structure-Based Virtual Ligand Screening Experiments

Bruno O. Villoutreix, Bentham Science Publisher, Nicolas Renault, Bentham Science Publisher, David Lagorce, Bentham Science Publisher, Olivier Sperandio, Bentham Science Publisher, Matthieu Montes, Be

Journal:

Current Protein & Peptide Science

Year:

2007

Language:

english

File:

PDF, 490 KB

english, 2007

8

A cell penetrating peptide targeting AAC-11 specifically induces cancer cells death

Jagot-Lacoussiere, L., Kotula, E., Villoutreix, B. O., Bruzzoni-Giovanelli, H., Poyet, J.-L.

Journal:

Cancer Research

Year:

2016

Language:

english

File:

PDF, 1.89 MB

english, 2016

9

An experimental study of fibre orientation in injection moulded short glass fibre-reinforced polypropylene/polyarylamide composites

A. Haddout, G. Villoutreix

Journal:

Year:

1994

Language:

english

File:

PDF, 882 KB

english, 1994

10

Author Correction: Intermediate degrees of synergistic pleiotropy drive adaptive evolution in ecological time

Frachon, Léa, Libourel, Cyril, Villoutreix, Romain, Carrère, Sébastien, Glorieux, Cédric, Huard-Chauveau, Carine, Navascués, Miguel, Gay, Laurène, Vitalis, Renaud, Baron, Etienne, Amsellem, Laurent, B

Journal:

Nature Ecology & Evolution

Year:

2018

Language:

english

File:

PDF, 749 KB

english, 2018

11

SHBG region of the anticoagulant cofactor protein S: Secondary structure prediction, circular dichroism spectroscopy, and analysis of naturally occurring mutations

Bruno. O. Villoutreix, Pablo García de Frutos, Magnus Lövenklev, Sara Linse, Per Fernlund, Björn Dahlbäck

Journal:

Proteins: Structure, Function, and Bioinformatics

Year:

1997

Language:

english

File:

PDF, 473 KB

english, 1997

12

Calcium binding to tandem repeats of EGF-like modules. Expression and characterization of the EGF-like modules of human Notch-1 implicated in receptor-ligand interactions

Matthew D. Rand, Anders Lindblom, Joyce Carlson, Bruno O. Villoutreix, Johan Stenflo

Journal:

Protein Science

Year:

1997

Language:

english

File:

PDF, 5.40 MB

english, 1997

13

Structural investigation of the A domains of human blood coagulation factor V by molecular modeling

Bruno O. Villoutreix, Björn Dahlbäck

Journal:

Protein Science

Year:

1998

Language:

english

File:

PDF, 5.30 MB

english, 1998

14

Proposed structural models of the prothrombinase (FXa–FVa) complex

Ludovic Autin, Mårten Steen, Björn Dahlbäck, Bruno O. Villoutreix

Journal:

Proteins: Structure, Function, and Bioinformatics

Year:

2006

Language:

english

File:

PDF, 777 KB

english, 2006

15

Biosynthèse des caroténoïdes acycliques chez un mutant de Rhodotorula mucilaginosa

NUSBAUMCASSUTO, E, VILLOUTREIX, J, MALENGS, J

Journal:

Biochimica et Biophysica Acta (BBA) - General Subjects

Year:

1967

File:

PDF, 705 KB

1967

16

The FAF-Drugs2 server: a multistep engine to prepare electronic chemical compound collections

Lagorce, D., Maupetit, J., Baell, J., Sperandio, O., Tuffery, P., Miteva, M. A., Galons, H., Villoutreix, B. O.

Journal:

Year:

2011

Language:

english

File:

PDF, 163 KB

english, 2011

17

MTiOpenScreen: a web server for structure-based virtual screening

Labbé, Céline M., Rey, Julien, Lagorce, David, Vavruša, Marek, Becot, Jérome, Sperandio, Olivier, Villoutreix, Bruno O., Tufféry, Pierre, Miteva, Maria A.

Journal:

Nucleic Acids Research

Year:

2015

Language:

english

File:

PDF, 1.29 MB

english, 2015

18

FAF-Drugs: free ADME/tox filtering of compound collections

Miteva, M. A., Violas, S., Montes, M., Gomez, D., Tuffery, P., Villoutreix, B. O.

Journal:

Nucleic Acids Research

Year:

2006

Language:

english

File:

PDF, 626 KB

english, 2006

19

Mutations in a potential phospholipid binding loop in the C2 domain of factor V affecting the assembly of the prothrombinase complex

Nicolaes, G. A. F., Villoutreix, B. O., Dahlbäck, B.

Journal:

Blood Coagulation & Fibrinolysis

Year:

2000

File:

PDF, 6.22 MB

2000

20

Influence de l'histoire thermomecanique sur la microstructure et sur certaines proprietes du polyoxymethylene injecte

A. Dimian, G. Villoutreix, R. Berlot

Journal:

European Polymer Journal

Year:

1989

File:

PDF, 1.12 MB

1989

21

1H and 13C NMR spectra of cis and trans phytoene isomers

P Granger, B Maudinas, R Herber, J Villoutreix

Journal:

Journal of Magnetic Resonance (1969)

Year:

1969

Language:

english

File:

PDF, 357 KB

english, 1969

22

Utilisation de la r.m.n.a haut champ pour la détermination de la structure de glucosides synthétisés par Mucor hiemalis

Pierre Granger, Régine Herber, Jean-Baptiste Villoutreix, Gordana Hajdukovic, Yves Chapleur

Journal:

Carbohydrate Research

Year:

1979

File:

PDF, 564 KB

1979

23

Utilisation de l'infliximab dans le traitement du rhumatisme psoriasique au cours de l'infection par le virus de l'immunodéficience humaine (VIH)

Jérémie Sellam, Béatrice Bouvard, Charles Masson, Mickael Rousière, Caroline Villoutreix, Karine Lacombe, Vanessa Khanine, Jean-Marie Chennebault, Christian Leclech, Maurice Audran, Francis Berenbaum

Journal:

Revue du Rhumatisme

Year:

2007

Language:

french

File:

PDF, 140 KB

french, 2007

24

Fast Structure-Based Virtual Ligand Screening Combining FRED, DOCK, and Surflex

Miteva, Maria A., Lee, Wen H., Montes, Matthieu O., Villoutreix, Bruno O.

Journal:

Journal of Medicinal Chemistry

Year:

2005

Language:

english

File:

PDF, 643 KB

english, 2005

25

Rationalizing the chemical space of protein–protein interaction inhibitors

Olivier Sperandio, Christelle H. Reynès, Anne-Claude Camproux, Bruno O. Villoutreix

Journal:

Drug Discovery Today

Year:

2010

Language:

english

File:

PDF, 1.45 MB

english, 2010

26

Tensin2 reduces intracellular phosphatidylinositol 3,4,5-trisphosphate levels at the plasma membrane

Sassan Hafizi, Anna Gustafsson, Cecilia Oslakovic, Olof Idevall-Hagren, Anders Tengholm, Olivier Sperandio, Bruno O. Villoutreix, Björn Dahlbäck

Journal:

Biochemical and Biophysical Research Communications

Year:

2010

Language:

english

File:

PDF, 646 KB

english, 2010

27

Mutations within the cyclooxygenase-1 gene in aspirin non-responders with recurrence of stroke

Andreas Hillarp, Barbro Palmqvist, Stefan Lethagen, Bruno O Villoutreix, Ingrid Mattiasson

Journal:

Thrombosis Research

Year:

2003

Language:

english

File:

PDF, 367 KB

english, 2003

28

Molecular basis of coagulation factor V deficiency caused by the R1698W inter-domain mutation

Calzavarini, S., Villoutreix, B. O., Lunghi, B., Livaja, R., Bernardi, F., Dahlbäck, B.

Journal:

Thrombosis and Haemostasis

Year:

2013

Language:

english

File:

PDF, 948 KB

english, 2013

29

Partial Glycosylation of Asn 2181 in Human Factor V as a Cause of Molecular and Functional Heterogeneity. Modulation of Glycosylation Efficiency by Mutagenesis of the Consensus Sequence for N-Linked Glycosylation †

Nicolaes, Gerry A. F., Villoutreix, Bruno O., Dahlbäck, Björn

Journal:

Year:

1999

Language:

english

File:

PDF, 207 KB

english, 1999

30

A Novel Interaction of Outer Membrane Protein A with C4b Binding Protein Mediates Serum Resistance of Escherichia coli K1

Prasadarao, N. V., Blom, A. M., Villoutreix, B. O., Linsangan, L. C.

Journal:

The Journal of Immunology

Year:

2002

Language:

english

File:

PDF, 544 KB

english, 2002

31

In silico design of low molecular weight protein–protein interaction inhibitors: Overall concept and recent advances

Kuenemann, Mélaine A., Sperandio, Olivier, Labbé, Céline M., Lagorce, David, Miteva, Maria A., Villoutreix, Bruno O.

Journal:

Progress in Biophysics and Molecular Biology

Year:

2015

Language:

english

File:

PDF, 1.78 MB

english, 2015

32

Discoidin Domains as Emerging Therapeutic Targets

Villoutreix, Bruno O., Miteva, Maria A.

Journal:

Trends in Pharmacological Sciences

Year:

2016

Language:

english

File:

PDF, 4.47 MB

english, 2016

33

Identification of insulin-sensitizing molecules acting by disrupting the interaction between the Insulin Receptor and Grb14

Gondoin, Anaïs, Hampe, Cornelia, Eudes, Richard, Fayolle, Cyril, Pierre-Eugène, Cécile, Miteva, Maria, Villoutreix, Bruno O., Charnay-Pouget, Florence, Aitken, David J., Issad, Tarik, Burnol, Anne-Fra

Journal:

Scientific Reports

Year:

2017

Language:

english

File:

PDF, 4.23 MB

english, 2017

34

Insights into an Original Pocket-Ligand Pair Classification: A Promising Tool for Ligand Profile Prediction

Pérot, Stéphanie, Regad, Leslie, Reynès, Christelle, Spérandio, Olivier, Miteva, Maria A., Villoutreix, Bruno O., Camproux, Anne-Claude, Kurgan, Lukasz

Journal:

Year:

2013

Language:

english

File:

PDF, 2.82 MB

english, 2013

35

Étude de l'influence du taux de greffage sur l'adhésivité d'un polyéthylène greffé acide acrylique et analyse par spectroscopie de photoelectrons de la surface des granules de polymère greffé

J. Villoutreix, P. Nogues, R. Berlot

Journal:

European Polymer Journal

Year:

1986

File:

PDF, 395 KB

1986

36

A structural model for the prostate disease marker, human prostate-specific antigen

Bruno O. Villoutreix, John H. Griffin, Elizabeth D. Getzoff

Journal:

Protein Science

Year:

1994

Language:

english

File:

PDF, 4.77 MB

english, 1994

37

Occurrence of trans-phytoene in microorganisms grown in the absence of carotenogenesis inhibitors

B. Maudinas, R. Herber, J. Villoutreix

Journal:

Biochimica et Biophysica Acta (BBA) - Lipids and Lipid Metabolism

Year:

1974

Language:

english

File:

PDF, 279 KB

english, 1974

38

Positively charged amino acids at the interface between α-chain CCP1 and CCP2 of C4BP are required for regulation of the classical C3-convertase

Anna M. Blom, Anna Foltyn Zadura, Bruno O. Villoutreix, Björn Dahlbäck

Journal:

Molecular Immunology

Year:

2000

Language:

english

File:

PDF, 863 KB

english, 2000

39

Influence de l'anaérobiose sur la composition en stérols de Mucor hiemalis

Herber, R., Villoutreix, J., Granger, P., Chapelle, S.

Journal:

Canadian Journal of Microbiology

Year:

1983

File:

PDF, 787 KB

1983

40

Compatibility of PVC-chlorinated PVC mixtures

Carmoin, B., Villoutreix, G., Berlot, R.

Journal:

Journal of Macromolecular Science Part B

Year:

1977

Language:

english

File:

PDF, 299 KB

english, 1977

41

Theileria parasites secrete a prolyl isomerase to maintain host leukocyte transformation

Marsolier, J., Perichon, M., DeBarry, J. D., Villoutreix, B. O., Chluba, J., Lopez, T., Garrido, C., Zhou, X. Z., Lu, K. P., Fritsch, L., Ait-Si-Ali, S., Mhadhbi, M., Medjkane, S., Weitzman, J. B.

Journal:

Year:

2015

Language:

english

File:

PDF, 2.54 MB

english, 2015

42

Computational analysis of calculated physicochemical and ADMET properties of protein-protein interaction inhibitors

Lagorce, David, Douguet, Dominique, Miteva, Maria A., Villoutreix, Bruno O.

Journal:

Scientific Reports

Year:

2017

Language:

english

File:

PDF, 1.56 MB

english, 2017

43

Factor VIII Inhibitors in Two Families with Mild Haemophilia A: Structural Analysis of the Mutations

Knobe, Karin E., Villoutreix, Bruno O., Tengborn, Lilian I., Petrini, Pia, Ljung, Rolf C.R.

Journal:

Pathophysiology of Haemostasis and Thrombosis

Year:

2000

Language:

english

File:

PDF, 241 KB

english, 2000

44

Gly74Ser mutation in protein C causes thrombosis due to a defect in protein S-dependent anticoagulant function

Chen, Changming, Yang, Likui, Villoutreix, Bruno O., Wang, Xuefeng, Ding, Qiulan, Rezaie, Alireza R.

Journal:

Thrombosis and Haemostasis

Year:

2017

Language:

english

File:

PDF, 830 KB

english, 2017

45

Prothrombin deficiency caused by compound heterozygosity for two novel mutations in the prothrombin gene associated with a bleeding tendency

Stanchev, Hristo, Philips, Malou, Villoutreix, Bruno O., Aksglæde, Lise, Lethagen, Stefan, Thorsen, Sixtus

Journal:

Thrombosis and Haemostasis

Year:

2006

File:

PDF, 262 KB

2006

46

Gly197Arg mutation in protein C causes recurrent thrombosis in a heterozygous carrier

Lu, Yeling, Giri, Hemant, Villoutreix, Bruno O., Ding, Qiulan, Wang, Xuefeng, Rezaie, Alireza R.

Journal:

Journal of Thrombosis and Haemostasis

Year:

2020

File:

PDF, 1.43 MB

2020

47

FastTargetPred: a program enabling the fast prediction of putative protein targets for input chemical databases

Chaput, Ludovic, Guillaume, Valentin, Singh, Natesh, Deprez, Benoit, Villoutreix, Bruno O, Wren, Jonathan

Journal:

Year:

2020

File:

PDF, 223 KB

2020

48

Structure-based drug repositioning over the human TMPRSS2 protease domain: search for chemical probes able to repress SARS-CoV-2 Spike protein cleavages

Singh, Natesh, Decroly, Etienne, Khatib, Abdel-Majid, Villoutreix, Bruno O.

Journal:

European Journal of Pharmaceutical Sciences

Year:

2020

File:

PDF, 1.47 MB

2020

49

AMMOS: Automated Molecular Mechanics Optimization tool forin silicoScreening

Tania Pencheva, David Lagorce, Ilza Pajeva, Bruno O Villoutreix, Maria A Miteva

Journal:

BMC Bioinformatics

Year:

2008

Language:

english

File:

PDF, 970 KB

english, 2008

50

Two Clusters of Charged Residues Located in the Electropositive Face of the Von Willebrand Factor A1 Domain Are Essential for Heparin Binding †

Rastegar-Lari, Ghassem, Villoutreix, Bruno O., Ribba, Anne-Sophie, Legendre, Paulette, Meyer, Dominique, Baruch, Dominique

Journal:

Year:

2002

Language:

english

File:

PDF, 771 KB

english, 2002

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