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Selective Fluorescent Nonpeptidic Antagonists For Vasopressin V2 GPCR: Application To Ligand Screening and Oligomerization Assays..
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Perrier, V.
(2011).
Oligomeric-Induced Activity by Thienyl Pyrimidine Compounds Traps Prion Infectivity.
Journal of Neuroscience
2011 31 (42), 14882-14892.
Brillet, K.,
Reimmann, C.,
Mislin, G. L. A.,
Noël, S.,
Rognan, D.,
Schalk, I. J.,
Cobessi, D.
(2011).
Pyochelin Enantiomers and Their Outer-Membrane Siderophore Transporters in Fluorescent Pseudomonads: Structural Bases for Unique Enantiospecific Recognition.
Journal of the American Chemical Society
2011 133 (41), 16503-16509.
De Wachter, R.,
De Graaf, C.,
Keresztes, A.,
Vandormael, B.,
Ballet, S.,
Tóth, G.,
Rognan, D.,
Tourwé, D.
(2011).
Synthesis, biological evaluation, and automated docking of constrained analogues of the opioid peptide H-Dmt-D-Ala-Phe-Gly-NH₂ using the 4- or 5-methyl substituted 4-amino-1,2,4,5-tetrahydro-2-benzazepin-3-one scaffold..
Journal of medicinal chemistry
2011 54 (19), 6538-6547.
Van Loenen, P. B.,
De Graaf, C.,
Verzijl, D.,
Leurs, R.,
Rognan, D.,
Peters, S. L. M.,
Alewijnse, A. E.
(2011).
Agonist-dependent effects of mutations in the sphingosine-1-phosphate type 1 receptor.
European Journal of Pharmacology
2011 667 (1), 105-112.
Garcia-Perez, J.,
Rueda, P.,
Alcami, J.,
Rognan, D.,
Arenzana-Seisdedos, F.,
Lagane, B.,
Kellenberger, E.
(2011).
Allosteric Model of Maraviroc Binding to CC Chemokine Receptor 5 (CCR5).
Journal of Biological Chemistry
2011 286 (38), 33409-33421.
Garcia-Perez, J.,
Rueda, P.,
Staropoli, I.,
Kellenberger, E.,
Alcami, J.,
Arenzana-Seisdedos, F.,
Lagane, B.
(2011).
New Insights into the Mechanisms whereby Low Molecular Weight CCR5 Ligands Inhibit HIV-1 Infection.
Journal of Biological Chemistry
2011 286 (7), 4978-4990.
Kuhn, I.,
Kellenberger, E.,
Said-Hassane, F.,
Villa, P.,
Rognan, D.,
Lobstein, A.,
Haiech, J.,
Hibert, M.,
Schuber, F.,
Muller-Steffner, H.
(2010).
Identification by high-throughput screening of inhibitors of Schistosoma mansoni NAD+ catabolizing enzyme.
Bioorganic & Medicinal Chemistry
2010 18 (22), 7900-7910.
Franchi, E. D.,
Schalon, C.,
Messa, M.,
Onofri, F.,
Benfenati, F.,
Rognan, D.
(2010).
Binding of Protein Kinase Inhibitors to Synapsin I Inferred from Pair-Wise Binding Site Similarity Measurements.
PLOS ONE
2010 5 (8), e12214-.
Chalopin, M.,
Tesse, A.,
Martínez, M. C.,
Rognan, D.,
Arnal, J.,
Andriantsitohaina, R.
(2010).
Estrogen Receptor Alpha as a Key Target of Red Wine Polyphenols Action on the Endothelium.
PLOS ONE
2010 5 (1), e8554-.
Shamovsky, I.,
De Graaf, C.,
Alderin, L.,
Bengtsson, M.,
Bladh, H.,
Börjesson, L.,
Connolly, S.,
Dyke, H. J.,
Van Den Heuvel, M.,
Johansson, H.,
Josefsson, B.,
Kristoffersson, A.,
Linnanen, T.,
Lisius, A.,
Männikkö, R.,
Nordén, B.,
Price, S.,
Ripa, L.,
Rognan, D.,
Rosendahl, A.,
Skrinjar, M.,
Urbahns, K.
(2009).
Increasing Selectivity of CC Chemokine Receptor 8 Antagonists by Engineering Nondesolvation Related Interactions with the Intended and Off-Target Binding Sites.
Journal of Medicinal Chemistry
2009 52 (23), 7706-7723.
Faure, H.,
Gorojankina, T.,
Rice, N.,
Dauban, P.,
Dodd, R. H.,
Bräuner-Osborne, H.,
Rognan, D.,
Ruat, M.
(2009).
Molecular determinants of non-competitive antagonist binding to the mouse GPRC6A receptor.
Cell Calcium
2009 46 (5), 323-332.
Hoegy, F.,
Lee, X.,
Noel, S.,
Rognan, D.,
Mislin, G. L. A.,
Reimmann, C.,
Schalk, I. J.
(2009).
Stereospecificity of the Siderophore Pyochelin Outer Membrane Transporters in Fluorescent Pseudomonads.
Journal of Biological Chemistry
2009 284 (22), 14949-14957.
Ballet, S.,
Feytens, D.,
Wachter, R. D.,
Vlaeminck, M. D.,
Marczak, E. D.,
Salvadori, S.,
Graaf, C.,
Rognan, D.,
Negri, L.,
Lattanzi, R.,
Lazarus, L. H.,
Tourwé, D.,
Balboni, G.
(2009).
Conformationally constrained opioid ligands: The Dmt-Aba and Dmt-Aia versus Dmt-Tic scaffold.
Bioorganic & Medicinal Chemistry Letters
2009 19 (2), 433-437.
Hachet-Haas, M.,
Balabanian, K.,
Rohmer, F.,
Pons, F.,
Franchet, C.,
Lecat, S.,
Chow, K. Y. C.,
Dagher, R.,
Gizzi, P.,
Didier, B.,
Lagane, B.,
Kellenberger, E.,
Bonnet, D.,
Baleux, F.,
Haiech, J.,
Parmentier, M.,
Frossard, N.,
Arenzana-Seisdedos, F.,
Hibert, M.,
Galzi, J.
(2008).
Small Neutralizing Molecules to Inhibit Actions of the Chemokine CXCL12.
Journal of Biological Chemistry
2008 283 (34), 23189-23199.
Schalon, C.,
Surgand, J.,
Kellenberger, E.,
Rognan, D.
(2008).
A simple and fuzzy method to align and compare druggable ligand-binding sites.
Proteins: Structure, Function, and Bioinformatics
2008 71 (4), 1755-1778.
Jiménez, M.,
André, S.,
Barillari, C.,
Romero, A.,
Rognan, D.,
Gabius, H.,
Solís, D.
(2008).
Domain versatility in plant AB-toxins: Evidence for a local, pH-dependent rearrangement in the 2γ lectin site of the mistletoe lectin by applying ligand derivatives and modelling.
FEBS Letters
2008 582 (15), 2309-2312.
Graaf, C.,
Foata, N.,
Engkvist, O.,
Rognan, D.
(2008).
Molecular modeling of the second extracellular loop of G-protein coupled receptors and its implication on structure-based virtual screening.
Proteins: Structure, Function, and Bioinformatics
2008 71 (2), 599-620.
Kellenberger, E.,
Springael, J.,
Parmentier, M.,
Hachet-Haas, M.,
Galzi, J.,
Rognan, D.
(2007).
Identification of Nonpeptide CCR5 Receptor Agonists by Structure-based Virtual Screening.
Journal of Medicinal Chemistry
2007 50 (6), 1294-1303.
Rodrigo, J.,
Pena, A.,
Murat, B.,
Trueba, M.,
Durroux, T.,
Guillon, G.,
Rognan, D.
(2007).
Mapping the Binding Site of Arginine Vasopressin to V1a and V1b Vasopressin Receptors.
Molecular Endocrinology
2007 21 (2), 512-523.
Zoffmann, S.,
Bertrand, S.,
Do, Q.,
Bertrand, D.,
Rognan, D.,
Hibert, M.,
Galzi, J.
(2007).
Topological analysis of the complex formed between neurokinin A and the NK2 tachykinin receptor.
Journal of Neurochemistry
2007 101 (2), 506-516.
Muller, P.,
Lena, G.,
Boilard, E.,
Bezzine, S.,
Lambeau, G.,
Guichard, G.,
Rognan, D.
(2006).
In Silico-Guided Target Identification of a Scaffold-Focused Library: 1,3,5-Triazepan-2,6-diones as Novel Phospholipase A2 Inhibitors.
Journal of Medicinal Chemistry
2006 49 (23), 6768-6778.
Gerber, S.,
Krasky, A.,
Rohwer, A.,
Lindauer, S.,
Closs, E.,
Rognan, D.,
Gunkel, N.,
Selzer, P. M.,
Wolf, C.
(2006).
Identification and characterisation of the dopamine receptor II from the cat flea Ctenocephalides felis (CfDopRII).
Insect Biochemistry and Molecular Biology
2006 36 (10), 749-758.
Kuhn, I.,
Kellenberger, E.,
Rognan, D.,
Lund, F. E.,
Muller-Steffner, H.,
Schuber, F.
(2006).
Redesign of Schistosoma mansoni NAD+ Catabolizing Enzyme: Active Site H103W Mutation Restores ADP-Ribosyl Cyclase Activity.
Biochemistry
2006 45 (39), 11867-11878.
Kessler, A.,
Faure, H.,
Petrel, C.,
Rognan, D.,
Césario, M.,
Ruat, M.,
Dauban, P.,
Dodd, R. H.
(2006).
N-Benzoyl-N-[1-(1-naphthyl)ethyl]-trans-1,2-diaminocyclohexanes: Development of 4-Chlorophenylcarboxamide (Calhex 231) as a New Calcium Sensing Receptor Ligand Demonstrating Potent Calcilytic Activity.
Journal of Medicinal Chemistry
2006 49 (17), 5119-5128.
Mislin, G. L. A.,
Hoegy, F.,
Cobessi, D.,
Poole, K.,
Rognan, D.,
Schalk, I. J.
(2006).
Binding Properties of Pyochelin and Structurally Related Molecules to FptA of Pseudomonas aeruginosa.
Journal of Molecular Biology
2006 357 (5), 1437-1448.
Kellenberger, E.,
Muller, P.,
Schalon, C.,
Bret, G.,
Foata, N.,
Rognan, D.
(2006).
sc-PDB: an Annotated Database of Druggable Binding Sites from the Protein Data Bank.
Journal of Chemical Information and Modeling
2006 46 (2), 717-727.
Mourot, A.,
Rodrigo, J.,
Kotzyba-Hibert, F.,
Bertrand, S.,
Bertrand, D.,
Goeldner, M.
(2006).
Probing the Reorganization of the Nicotinic Acetylcholine Receptor during Desensitization by Time-Resolved Covalent Labeling Using [3H]AC5, a Photoactivatable Agonist.
Molecular Pharmacology
2006 69 (2), 452-461.
Surgand, J.,
Rodrigo, J.,
Kellenberger, E.,
Rognan, D.
(2006).
A chemogenomic analysis of the transmembrane binding cavity of human G-protein-coupled receptors.
Proteins: Structure, Function, and Bioinformatics
2006 62 (2), 509-538.
Silve, C.,
Petrel, C.,
Leroy, C.,
Bruel, H.,
Mallet, E.,
Rognan, D.,
Ruat, M.
(2005).
Delineating a Ca2+ Binding Pocket within the Venus Flytrap Module of the Human Calcium-sensing Receptor.
Journal of Biological Chemistry
2005 280 (45), 37917-37923.
Goodrich, S. P.,
Muller-Steffner, H.,
Osman, A.,
Moutin, M.,
Kusser, K.,
Roberts, A.,
Woodland, D. L.,
Randall, T. D.,
Kellenberger, E.,
LoVerde, P. T.,
Schuber, F.,
Lund, F. E.
(2005).
Production of Calcium-Mobilizing Metabolites by a Novel Member of the ADP-Ribosyl Cyclase Family Expressed in Schistosoma mansoni,.
Biochemistry
2005 44 (33), 11082-11097.
Houben, K.,
Wasielewski, E.,
Dominguez, C.,
Kellenberger, E.,
Atkinson, R. A.,
Timmers, H. T. M.,
Kieffer, B.,
Boelens, R.
(2005).
Dynamics and Metal Exchange Properties of C4C4 RING Domains from CNOT4 and the p44 Subunit of TFIIH.
Journal of Molecular Biology
2005 349 (3), 621-637.
Krier, M.,
De Araújo-Júnior, J. X.,
Schmitt, M.,
Duranton, J.,
Justiano-Basaran, H.,
Lugnier, C.,
Bourguignon, J.,
Rognan, D.
(2005).
Design of Small-Sized Libraries by Combinatorial Assembly of Linkers and Functional Groups to a Given Scaffold: Application to the Structure-Based Optimization of a Phosphodiesterase 4 Inhibitor.
Journal of Medicinal Chemistry
2005 48 (11), 3816-3822.
Kellenberger, E.,
Dominguez, C.,
Fribourg, S.,
Wasielewski, E.,
Moras, D.,
Poterszman, A.,
Boelens, R.,
Kieffer, B.
(2005).
Solution Structure of the C-terminal Domain of TFIIH P44 Subunit Reveals a Novel Type of C4C4 Ring Domain Involved in Protein-Protein Interactions.
Journal of Biological Chemistry
2005 280 (21), 20785-20792.
Violette, A.,
Averlant-Petit, M. C.,
Semetey, V.,
Hemmerlin, C.,
Casimir, R.,
Graff, R.,
Marraud, M.,
Briand, J.,
Rognan, D.,
Guichard, G.
(2005).
N,N‘-Linked Oligoureas as Foldamers: Chain Length Requirements for Helix Formation in Protic Solvent Investigated by Circular Dichroism, NMR Spectroscopy, and Molecular Dynamics.
Journal of the American Chemical Society
2005 127 (7), 2156-2164.
Moris, M.,
Caron, A. Z.,
Guillemette, G.,
Rognan, D.,
Schmitt, M.,
Schlewer, G.
(2005).
Synthesis of (±)-2-O-[4‘-(N-9‘ ‘-Purinyl)butyl] myo-Inositol 1,4,5-Tris(phosphate), a Potent Full Agonist at the d-myo-Inositol 1,4,5-Tris(phosphate) Receptor.
Journal of Medicinal Chemistry
2005 48 (4), 1251-1255.
Derick, S.,
Pena, A.,
Durroux, T.,
Wagnon, J.,
Serradeil-Le Gal, C.,
Hibert, M.,
Rognan, D.,
Guillon, G.
(2004).
Key Amino Acids Located within the Transmembrane Domains 5 and 7 Account for the Pharmacological Specificity of the Human V1b Vasopressin Receptor.
Molecular Endocrinology
2004 18 (11), 2777-2789.
Traiffort, E.,
Dubourg, C.,
Faure, H.,
Rognan, D.,
Odent, S.,
Durou, M.,
David, V.,
Ruat, M.
(2004).
Functional Characterization of Sonic Hedgehog Mutations Associated with Holoprosencephaly.
Journal of Biological Chemistry
2004 279 (41), 42889-42897.
Stote, R. H.,
Kellenberger, E.,
Muller, H.,
Bombarda, E.,
Roques, B. P.,
Kieffer, B.,
Mély, Y.
(2004).
Structure of the His44 → Ala Single Point Mutant of the Distal Finger Motif of HIV-1 Nucleocapsid Protein: A Combined NMR, Molecular Dynamics Simulation, and Fluorescence Study.
Biochemistry
2004 43 (24), 7687-7697.
Petrel, C.,
Kessler, A.,
Dauban, P.,
Dodd, R. H.,
Rognan, D.,
Ruat, M.
(2004).
Positive and Negative Allosteric Modulators of the Ca2+-sensing Receptor Interact within Overlapping but Not Identical Binding Sites in the Transmembrane Domain.
Journal of Biological Chemistry
2004 279 (18), 18990-18997.
Kellenberger, E.,
Rodrigo, J.,
Muller, P.,
Rognan, D.
(2004).
Comparative evaluation of eight docking tools for docking and virtual screening accuracy.
Proteins: Structure, Function, and Bioinformatics
2004 57 (2), 225-242.
Paul, N.,
Kellenberger, E.,
Bret, G.,
Müller, P.,
Rognan, D.
(2004).
Recovering the true targets of specific ligands by virtual screening of the protein data bank.
Proteins: Structure, Function, and Bioinformatics
2004 54 (4), 671-680.
Petrel, C.,
Kessler, A.,
Maslah, F.,
Dauban, P.,
Dodd, R. H.,
Rognan, D.,
Ruat, M.
(2003).
Modeling and Mutagenesis of the Binding Site of Calhex 231, a Novel Negative Allosteric Modulator of the Extracellular Ca2+-sensing Receptor.
Journal of Biological Chemistry
2003 278 (49), 49487-49494.
Tahtaoui, C.,
Balestre, M.,
Klotz, P.,
Rognan, D.,
Barberis, C.,
Mouillac, B.,
Hibert, M.
(2003).
Identification of the Binding Sites of the SR49059 Nonpeptide Antagonist into the V1a Vasopressin Receptor Using Sulfydryl-reactive Ligands and Cysteine Mutants as Chemical Sensors.
Journal of Biological Chemistry
2003 278 (41), 40010-40019.
Bissantz, C.,
Bernard, P.,
Hibert, M.,
Rognan, D.
(2003).
Protein-based virtual screening of chemical databases. II. Are homology models of g-protein coupled receptors suitable targets?.
Proteins: Structure, Function, and Bioinformatics
2003 50 (1), 5-25.
Kratz, F.,
Warnecke, A.,
Scheuermann, K.,
Stockmar, C.,
Schwab, J.,
Lazar, P.,
Drückes, P.,
Esser, N.,
Drevs, J.,
Rognan, D.,
Bissantz, C.,
Hinderling, C.,
Folkers, G.,
Fichtner, I.,
Unger, C.
(2002).
Probing the cysteine-34 position of endogenous serum albumin with thiol-binding doxorubicin derivatives. Improved efficacy of an acid-sensitive doxorubicin derivative with specific albumin-binding properties compared to that of the parent compound..
Journal of medicinal chemistry
2002 45 (25), 5523-5533.
Ramos, M.,
Alvarez, I.,
Sesma, L.,
Logean, A.,
Rognan, D.,
López De Castro, J. A.
(2002).
Molecular Mimicry of an HLA-B27-derived Ligand of Arthritis-linked Subtypes with Chlamydial Proteins.
Journal of Biological Chemistry
2002 277 (40), 37573-37581.
Demuth, C.,
Zerbe, O.,
Rognan, D.,
Söll, R.,
Beck-Sickinger, A.,
Folkers, G.,
Spichiger, U. E.
(2001).
A rationally designed oligopeptide shows significant conformational changes upon binding to sulphate ions..
Biosensors & bioelectronics
2001 16 (9-12), 783-789.
Dédier, S.,
Reinelt, S.,
Rion, S.,
Folkers, G.,
Rognan, D.
(2001).
Use of fluorescence polarization to monitor MHC-peptide interactions in solution..
Journal of immunological methods
2001 255 (1-2), 57-66.
Rognan, D.,
Bissantz, C.,
Dédier, S.,
Logean, A.,
Reinelt, S.
(2000).
Synergistic Use of Virtual Screening and Biophysical Methods for the Protein-Based Design of Peptidomimetics.
CHIMIA International Journal for Chemistry
2000 54 (11), 658-662.
Fribourg, S.,
Kellenberger, E.,
Rogniaux, H.,
Poterszman, A.,
Dorsselaer, A. V.,
Thierry, J.,
Egly, J.,
Moras, D.,
Kieffer, B.
(2000).
Structural Characterization of the Cysteine-rich Domain of TFIIH p44 Subunit.
Journal of Biological Chemistry
2000 275 (41), 31963-31971.
Dédier, S.,
Reinelt, S.,
Reitinger, T.,
Folkers, G.,
Rognan, D.
(2000).
Thermodynamic stability of HLA-B*2705. Peptide complexes. Effect of peptide and major histocompatibility complex protein mutations..
The Journal of biological chemistry
2000 275 (35), 27055-27061.
Yagüe, J.,
Alvarez, I.,
Rognan, D.,
Ramos, M.,
Vázquez, J.,
De Castro, J. A. L.
(2000).
An N-Acetylated Natural Ligand of Human Histocompatibility Leukocyte Antigen (Hla)-B39.
The Journal of Experimental Medicine
2000 191 (12), 2083-2092.
Rognan, D.,
Stryhn, A.,
Fugger, L.,
Lyngbæk, S.,
Engberg, J.,
Andersen, P. S.,
Buus, S.
(2000).
Modeling the interactions of a peptide-major histocompatibility class I ligand with its receptors. I. Recognition by two αβ T cell receptors.
Journal of Computer-Aided Molecular Design
2000 14 (1), 53-69.
Rognan, D.,
Engberg, J.,
Stryhn, A.,
Andersen, P. S.,
Buus, S.
(2000).
Modeling the interactions of a peptide-major histocompatibility class I ligand with its receptors. II. Cross-reaction between a monoclonal antibody and two αβ T cell receptors.
Journal of Computer-Aided Molecular Design
2000 14 (1), 71-82.
Rognan, D.,
Lauemoller, S. L.,
Holm, A.,
Buus, S.,
Tschinke, V.
(1999).
Predicting binding affinities of protein ligands from three-dimensional models: application to peptide binding to class I major histocompatibility proteins..
Journal of medicinal chemistry
1999 42 (22), 4650-4658.
Poenaru, S.,
Lamas, J. R.,
Folkers, G.,
López De Castro, J. A.,
Seebach, D.,
Rognan, D.
(1999).
Nonapeptide Analogues Containing (R)-3-Hydroxybutanoate and β-Homoalanine Oligomers: Synthesis and Binding Affinity to a Class I Major Histocompatibility Complex Protein.
Journal of Medicinal Chemistry
1999 42 (13), 2318-2331.
Kellenberger, E.,
Mer, G.,
Kellenberger, C.,
Marguerie, G.,
Lefèvre, J. F.
(1999).
Solution structure of a conformationally constrained Arg-Gly-Asp-like motif inserted into the alpha/beta scaffold of leiurotoxin I..
European journal of biochemistry
1999 260 (3), 810-817.
Deadier, S.,
Krebs, S.,
Lamas, J. R.,
Poenaru, S.,
Folkers, G.,
Castro, J. A. L.,
Seebach, D.,
Rognan, D.
(1999).
Structure-Based Design of Nonnatural Ligands for the HLA-B27 Protein.
Journal of Receptors and Signal Transduction
1999 19 (1-4), 645-657.
Paradela, A.,
García-Peydró, M.,
Vázquez, J.,
Rognan, D.,
López De Castro, J. A.
(1998).
The same natural ligand is involved in allorecognition of multiple HLA-B27 subtypes by a single T cell clone: role of peptide and the MHC molecule in alloreactivity..
Journal of immunology (Baltimore, Md. : 1950)
1998 161 (10), 5481-5490.
Forstner, M.,
Müller, A.,
Rognan, D.,
Kriechbaum, M.,
Wallimann, T.
(1998).
Mutation of cis-proline 207 in mitochondrial creatine kinase to alanine leads to increased acid stability..
Protein engineering
1998 11 (7), 563-568.
Krebs, S.,
Lamas, J. R.,
Poenaru, S.,
Folkers, G.,
De Castro, J. A.,
Seebach, D.,
Rognan, D.
(1998).
Substituting nonpeptidic spacers for the T cell receptor-binding part of class I major histocompatibility complex-binding peptides..
The Journal of biological chemistry
1998 273 (30), 19072-19079.
García, R.,
Rognan, D.,
Lamas, J. R.,
Marina, A.,
Castro, J. A. L.
(1998).
An HLA-B27 polymorphism (B*2710) that is critical for T-cell recognition has limited effects on peptide specificity.
Tissue Antigens
1998 51 (1), 1-9.
Rognan, D.,
Krebs, S.,
Kuonen, O.,
Lamas, J. R.,
López De Castro, J. A.,
Folkers, G.
(1997).
Fine specificity of antigen binding to two class I major histocompatibility proteins (B*2705 and B*2703) differing in a single amino acid residue..
Journal of computer-aided molecular design
1997 11 (5), 463-478.
Lang, v. B.,
Langguth, P.,
Ottiger, C.,
Wunderli-Allenspach, H.,
Rognan, D.,
Rothen-Rutishauser, B.,
Perriard, J.,
Lang, S.,
Biber, J.,
Merkle, H. P.
(1997).
Structure-Permeation Relations of Met-enkephalin Peptide Analogues on Absorption and Secretion Mechanisms in Caco-2 Monolayers.
Journal of Pharmaceutical Sciences
1997 86 (7), 846-853.
Rognan, D.,
Boulanger, T.,
Hoffmann, R.,
Vercauteren, D. P.,
Andre, J. M.,
Durant, F.,
Wermuth, C. G.
(1992).
Structure and molecular modeling of GABA-A receptor antagonists..
Journal of medicinal chemistry
1992 35 (11), 1969-1977.
Rognan, D.,
Reddehase, M. J.,
Koszinowski, U. H.,
Folkers, G.
(1992).
Molecular modeling of an antigenic complex between a viral peptide and a class I major histocompatibility glycoprotein.
Proteins: Structure, Function, and Bioinformatics
1992 13 (1), 70-85.
Zimmermann, N.,
Rötzschke, O.,
Falk, K.,
Rognan, D.,
Folkers, G.,
Rammensee, H.,
Jung, G.
(1992).
Molecular Modeling of the Class I Human Histocompatibility Molecule HLA-A2 Presenting an Allele-Specific Nonapeptide from Influenza Matrix Protein.
Angewandte Chemie International Edition in English
1992 31 (7), 886-890.
Zimmermann, N.,
Rötzschke, O.,
Falk, K.,
Rognan, D.,
Folkers, G.,
Rammensee, H.,
Jung, G.
(1992).
Moleküldynamiksimulation für ein allelspezifisches virales Nonapeptid aus dem Influenza-Matrix-protein in der Bindungstasche eines menschlichen MHC-Klasse-I-Proteins.
Angewandte Chemie
1992 104 (7), 928-931.
Rognan, D.,
Sokoloff, P.,
Mann, A.,
Martres, M.,
Schwartz, J.,
Costentin, J.,
Wermuth, C.
(1990).
Optically active benzamides as predictive tools for mapping the dopamine D2 receptor.
European Journal of Pharmacology: Molecular Pharmacology
1990 189 (1), 59-70.