Thierry Langer

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Gerhard WolberProfessor for Pharmaceutical ChemistryDirección de correo verificada de fu-berlin.de
Daniela SchusterProfessor and Head of the Department of Pharmaceutical and Medicinal Chemistry at the ParacelsusDirección de correo verificada de pmu.ac.at
Johannes KirchmairUniversity of ViennaDirección de correo verificada de univie.ac.at
Judith RollingerUniversity of ViennaDirección de correo verificada de univie.ac.at
VITTORIO PACEUniversity of Vienna - Department of Pharmaceutical ChemistryDirección de correo verificada de ucm.es
Gudrun SpitzerUniversität InnsbruckDirección de correo verificada de liedllab.org
Stefano AlcaroNet4Science spinoff & Dipartimento di Scienze della Salute - UMG di Catanzaro (Italy)Dirección de correo verificada de unicz.it
Francesco OrtusoUniversità "Magna Graecia" di CatanzaroDirección de correo verificada de unicz.it
Anzini MaurizioProfessore Associato Confermato di Chimica Farmaceutica e Tossicologica,Università di SienaDirección de correo verificada de unisi.it
Gerhard F EckerProfessor of Pharmacoinformatics, University of ViennaDirección de correo verificada de univie.ac.at
Klaus LiedlProfessor for Theoretical Chemistry, University of InnsbruckDirección de correo verificada de uibk.ac.at
Paolo PaoliDipartimento di Scienze Biomediche Sperimentali e Cliniche, Università degli Studi di FirenzeDirección de correo verificada de unifi.it
Thomas M. WeigerUniversity of Salzburg Department of BiosciencesDirección de correo verificada de sbg.ac.at
Anton HermannProfessor of Physiology em, University SalzburgDirección de correo verificada de sbg.ac.at
Ulrike GrienkeUniversity of ViennaDirección de correo verificada de univie.ac.at
Maria cristina MenzianiUniversità di Modena e Reggio EmiliaDirección de correo verificada de unimore.it
Hartmut GlossmannFull Professor M.D. PhD. Qualified Specialist In Pharmacology,Toxicology and Clinical PharmacologyDirección de correo verificada de i-med.ac.at
Andreas BenderUniversity of Cambridge; Pangea Bio; Universitatea Babeș-BolyaiDirección de correo verificada de cam.ac.uk
Gary TresadernComputational chemistry, Johnson & Johnson Innovative MedicineDirección de correo verificada de its.jnj.com
T. SciorProfesor e Investigador, BENEMERITA UNIVERSIDAD AUTONOMA DE PUEBLADirección de correo verificada de correo.buap.mx

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Thierry Langer

University of Innsbruck, University of Vienna

Dirección de correo verificada de univie.ac.at

medicinal chemistry computer-aided molecular design pharmacology


Título Ordenar por citas Ordenar por año Ordenar por título	Citado por Citado por	Año
LigandScout: 3-D pharmacophores derived from protein-bound ligands and their use as virtual screening filters G Wolber, T Langer Journal of chemical information and modeling 45 (1), 160-169, 2005	2089	2005
Why drugs fail-a study on side effects in new chemical entities D Schuster, C Laggner, T Langer Current pharmaceutical design 11 (27), 3545-3559, 2005	499	2005
Recognizing pitfalls in virtual screening: a critical review T Scior, A Bender, G Tresadern, JL Medina-Franco, K Martínez-Mayorga, ... Journal of chemical information and modeling 52 (4), 867-881, 2012	488	2012
Evaluation of the performance of 3D virtual screening protocols: RMSD comparisons, enrichment assessments, and decoy selection—what can we learn from earlier mistakes? J Kirchmair, P Markt, S Distinto, G Wolber, T Langer Journal of computer-aided molecular design 22, 213-228, 2008	446	2008
A compact review of molecular property prediction with graph neural networks O Wieder, S Kohlbacher, M Kuenemann, A Garon, P Ducrot, T Seidel, ... Drug Discovery Today: Technologies 37, 1-12, 2020	392	2020
Molecule-pharmacophore superpositioning and pattern matching in computational drug design G Wolber, T Seidel, F Bendix, T Langer Drug discovery today 13 (1-2), 23-29, 2008	376	2008
Efficient overlay of small organic molecules using 3D pharmacophores G Wolber, AA Dornhofer, T Langer Journal of computer-aided molecular design 20 (12), 773-788, 2006	371	2006
Recent advances in docking and scoring EM Krovat, T Steindl, T Langer Current computer-aided drug design 1 (1), 93-102, 2005	287	2005
Acetylcholinesterase inhibitory activity of scopolin and scopoletin discovered by virtual screening of natural products JM Rollinger, A Hornick, T Langer, H Stuppner, H Prast Journal of medicinal chemistry 47 (25), 6248-6254, 2004	280	2004
Virtual screening for the discovery of bioactive natural products JM Rollinger, H Stuppner, T Langer Natural compounds as drugs Volume I, 211-249, 2008	264	2008
Pharmacophores and pharmacophore searches R Mannhold, H Kubinyi, G Folkers Wiley-Vch, 2006	257	2006
Virtual screening an effective tool for lead structure discovery T Langer, RD Hoffmann Current pharmaceutical design 7 (7), 509-527, 2001	219	2001
Computational medicinal chemistry for drug discovery P Bultinck, H De Winter, W Langenaeker, JP Tollenare CRC Press, 2003	205	2003
Comparative performance assessment of the conformational model generators omega and catalyst: a large-scale survey on the retrieval of protein-bound ligand conformations J Kirchmair, G Wolber, C Laggner, T Langer Journal of chemical information and modeling 46 (4), 1848-1861, 2006	192	2006
The discovery of new 11β-hydroxysteroid dehydrogenase type 1 inhibitors by common feature pharmacophore modeling and virtual screening D Schuster, EM Maurer, C Laggner, LG Nashev, T Wilckens, T Langer, ... Journal of medicinal chemistry 49 (12), 3454-3466, 2006	166	2006
In silico target fishing for rationalized ligand discovery exemplified on constituents of Ruta graveolens JM Rollinger, D Schuster, B Danzl, S Schwaiger, P Markt, M Schmidtke, ... Planta medica 75 (03), 195-204, 2009	150	2009
Comparative analysis of protein-bound ligand conformations with respect to catalyst's conformational space subsampling algorithms J Kirchmair, C Laggner, G Wolber, T Langer Journal of chemical information and modeling 45 (2), 422-430, 2005	149	2005
Discovery of high-affinity ligands of σ1 receptor, ERG2, and emopamil binding protein by pharmacophore modeling and virtual screening C Laggner, C Schieferer, B Fiechtner, G Poles, RD Hoffmann, ... Journal of medicinal chemistry 48 (15), 4754-4764, 2005	148	2005
Chemical feature-based pharmacophores and virtual library screening for discovery of new leads. T Langer, EM Krovat Current opinion in drug discovery & development 6 (3), 370-376, 2003	148	2003
Strategies for efficient lead structure discovery from natural products JM Rollinger, T Langer, H Stuppner Current medicinal chemistry 13 (13), 1491-1507, 2006	147	2006

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