P. Selzer

发表

The Impact of Tautomer Forms on Pharmacophore-Based Virtual Screening

Paul M. Selzer, Frank Oellien, Jörg Cramer, 2006, J. Chem. Inf. Model..

Fast calculation of molecular polar surface area as a sum of fragment-based contributions and its application to the prediction of drug transport properties.

P. Selzer, P. Ertl, B. Rohde, 2000, Journal of medicinal chemistry.

Complex molecules: do they add value?

A. Schuffenhauer, P. Selzer, P. Ertl, 2005, Current opinion in chemical biology.

Chemical Information in 3D Space

J. Gasteiger, J. Sadowski, P. Selzer, 1997 .

Molecular visualization in the rational drug design process.

J. Brickmann, P. Selzer, M. Keil, 2009, Frontiers in bioscience.

Imatinib Treatment Causes Substantial Transcriptional Changes in Adult Schistosoma mansoni In Vitro Exhibiting Pleiotropic Effects

Richard J. Marhöfer, K. C. Oliveira, P. Selzer, 2014, PLoS neglected tropical diseases.

Identification and characterisation of the dopamine receptor II from the cat flea Ctenocephalides felis (CfDopRII).

Didier Rognan, Andreas Rohwer, Paul M Selzer, 2006, Insect biochemistry and molecular biology.

Identification and Classification of GPCR Ligands Using Self‐Organizing Neural Networks

P. Selzer, P. Ertl, 2005 .

How Phenotypic Screening Influenced Drug Discovery: Lessons from Five Years of Practice.

P. Selzer, U. Schopfer, C. Antczak, 2017, Assay and drug development technologies.

Differentiation and Visualization of Diverse Cellular Phenotypic Responses in Primary High-Content Screening

P. Selzer, C. Parker, Y. Ibig-Rehm, 2012, Journal of biomolecular screening.

Inhibition of Eimeria tenella CDK‐Related Kinase 2: From Target Identification to Lead Compounds

Richard J. Marhöfer, C. Beyer, P. Selzer, 2010, ChemMedChem.

Correlations between Chemical Structure and Infrared Spectra

P. Selzer, 2008 .

Finding the 3D structure of a molecule in its IR spectrum

J. Gasteiger, P. Selzer, J. Schuur, 1997 .

Biodiversity of small molecules--a new perspective in screening set selection.

Anne Mai Wassermann, Eugen Lounkine, Meir Glick, 2013, Drug discovery today.

Quest for the rings. In silico exploration of ring universe to identify novel bioactive heteroaromatic scaffolds.

Peter Ertl, Ansgar Schuffenhauer, Jörg Mühlbacher, 2006, Journal of medicinal chemistry.

Clustering and Rule‐Based Classifications of Chemical Structures Evaluated in the Biological Activity Space.

Paul M. Selzer, Jeremy L. Jenkins, Peter Ertl, 2007 .

Expression and alteration of the S2 subsite of the Leishmania major cathepsin B-like cysteine protease.

P. Selzer, J. McKerrow, V. Chan, 1999, The Biochemical journal.

Library design for fragment based screening.

Edgar Jacoby, Ansgar Schuffenhauer, Wolfgang Jahnke, 2005, Current topics in medicinal chemistry.

Comparison of Multivariate Data Analysis Strategies for High-Content Screening

Anne Kümmel, Hanspeter Gubler, Martin Beibel, 2011, Journal of biomolecular screening.

Identification of Semicarbazones, Thiosemicarbazones and Triazine Nitriles as Inhibitors of Leishmania mexicana Cysteine Protease CPB

Richard J. Marhöfer, P. Selzer, G. H. Coombs, 2013, PloS one.

Identification of Lead Compounds Targeting the Cathepsin B-Like Enzyme of Eimeria tenella

P. Selzer, G. H. Coombs, J. Mottram, 2011, Antimicrobial Agents and Chemotherapy.

Structure-based design of parasitic protease inhibitors.

R J Fletterick, F E Cohen, G L Kenyon, 1996, Bioorganic & medicinal chemistry.

Drug discovery and the use of computational approaches for infectious diseases.

Richard J. Marhöfer, Frank Oellien, P. Selzer, 2011, Future medicinal chemistry.

IR Spectra Simulation and Information Processing on the WWW

P. Selzer, 1998, CHIMIA.

Blocking Transmission of Vector-borne Diseases

P. Selzer, R. Kaminsky, S. Noack, 2018, Ectoparasites.

Blocking transmission of vector-borne diseases

P. Selzer, R. Kaminsky, S. Noack, 2017, International journal for parasitology. Drugs and drug resistance.

Characterisation of Tc-cpl-1, a cathepsin L-like cysteine protease from Toxocara canis infective larvae.

R. Maizels, A. Loukas, P. Selzer, 1998, Molecular and biochemical parasitology.

Sequence Comparisons and Sequence-Based Database Searches

Richard J. Marhöfer, P. Selzer, O. Koch, 2018 .

15. protein kinases as suitable targets for combating Eimeria spp.

Richard J. Marhöfer, P. Selzer, J. Mottram, 2013 .

The Functional Analysis of Genomes

Richard J. Marhöfer, P. Selzer, O. Koch, 2018 .

Infrared Data Correlations with Chemical Structure

P. Selzer, 2002 .

Drug Discovery Approaches toward Anti‐Parasitic Agents

Richard J. Marhöfer, P. Selzer, C. Caffrey, 2011 .

1 Drug Discovery Approaches Toward AntiParasitic Agents

P. Selzer, C. Caffrey, A. Rohwer, 2010 .

Molecular Dynamics Reveal Binding Mode of Glutathionylspermidine by Trypanothione Synthetase

P. Selzer, C. Sotriffer, L. Flohé, 2013, PloS one.

Antiparasitic and antibacterial drug discovery : from molecular targets to drug candidates

P. Selzer, 2009 .

Orlistat: A Repositioning Opportunity as a Growth Inhibitor of Apicomplexan Parasites?

P. Selzer, A. Heckeroth, H. Q. Tran, 2011 .

The Decoding of Eukaryotic Genomes

Richard J. Marhöfer, P. Selzer, O. Koch, 2018 .

The second largest subunit of Trypanosoma brucei's multifunctional RNA polymerase I has a unique N-terminal extension domain.

Richard J. Marhöfer, P. Selzer, A. Günzl, 2003, Molecular and biochemical parasitology.

Pyruvate Fermentation by Oenococcus oeni and Leuconostoc mesenteroides and Role of Pyruvate Dehydrogenase in Anaerobic Fermentation

P. Selzer, H. Richter, G. Unden, 2005, Applied and Environmental Microbiology.

Antiparasitics in Animal Health: Quo Vadis?

P. Selzer, C. Epe, 2020, Trends in parasitology.

Structure-based design, synthesis and evaluation of conformationally constrained cysteine protease inhibitors.

P. Selzer, P. Rosenthal, J. McKerrow, 1998, Bioorganic & medicinal chemistry.

Applications of Self-Organizing Neural Networks in Virtual Screening and Diversity Selection

Peter Ertl, Paul Selzer, P. Selzer, 2006, J. Chem. Inf. Model..

Anticoccidial drugs of the livestock industry

P. Selzer, S. Noack, H. D. Chapman, 2019, Parasitology Research.

High-throughput screening with the Eimeria tenella CDC2-related kinase2/cyclin complex EtCRK2/EtCYC3a

Richard J. Marhöfer, P. Selzer, J. Mottram, 2012, Microbiology.

Isoxazolines: A Novel Chemotype Highly Effective on Ectoparasites

P. Selzer, T. Weber, 2016, ChemMedChem.

Identification and Profiling of Nematicidal Compounds in Veterinary Parasitology

P. Selzer, A. Rohwer, C. Chassaing, 2012 .

Heartworm disease – Overview, intervention, and industry perspective

P. Selzer, R. Kaminsky, S. Noack, 2021, International journal for parasitology. Drugs and drug resistance.

Cysteine protease inhibitors as chemotherapy: lessons from a parasite target.

M. Bogyo, P. Selzer, J. McKerrow, 1999, Proceedings of the National Academy of Sciences of the United States of America.

Down regulation of S-adenosyl-L-methionine decarboxylase activity of Trypanosoma brucei during transition from long slender to short stumpy-like forms in axenic culture.

P. Selzer, F. Hesse, M. Duszenko, 1996, European journal of cell biology.

High-throughput screening with the Eimeria tenella CDC 2-related kinase 2 / cyclin complex EtCRK 2 / EtCYC 3 a Marı́a

Richard J. Marhöfer, P. Selzer, J. Mottram, 2012 .

A combined bioinformatics and chemoinformatics approach for the development of new antiparasitic drugs.

P. Selzer, A. Krasky, A. Rohwer, 2007, Genomics.

Leishmania major: molecular modeling of cysteine proteases and prediction of new nonpeptide inhibitors.

F E Cohen, G L Kenyon, F. Cohen, 1997, Experimental parasitology.

Genlight: Interactive high-throughput sequence analysis and comparative genomics

Michael Beckstette, Jens T. Mailänder, Richard J. Marhöfer, 2004, J. Integr. Bioinform..

Target-based drug discovery for the development of novel antiinfectives.

P. Selzer, P. Wiesner, P. Schmid, 2000, International journal of medical microbiology : IJMM.

Linking phenotypes and modes of action through high-content screen fingerprints.

Daniela Gabriel, Felix Reisen, Martin Pfeifer, 2015, Assay and drug development technologies.

Comparative Genome Analyses

Richard J. Marhöfer, Paul M. Selzer, Oliver Koch, 2018 .

Decision support systems for chemical structure representation, reaction modeling, and spectra simulation

J Gasteiger, Markus C. Hemmer, J. Gasteiger, 2002, SAR and QSAR in environmental research.

Protein Structures and Structure-Based Rational Drug Design

Richard J. Marhöfer, P. Selzer, O. Koch, 2004 .

Design, Synthesis and Evaluation of d-Homophenylalanyl Epoxysuccinate Inhibitors of the Trypanosomal Cysteine Protease Cruzain

Paul M. Selzer, William R. Roush, P. Selzer, 2000 .

Clustering and Rule-Based Classifications of Chemical Structures Evaluated in the Biological Activity Space

Jeremy L. Jenkins, Peter Ertl, Nathan Brown, 2007, J. Chem. Inf. Model..

The RESOLUTE consortium: unlocking SLC transporters for drug discovery

D. Kell, G. Superti-Furga, R. Everley, 2020, Nature Reviews Drug Discovery.

Docking-based virtual screening of covalently binding ligands: an orthogonal lead discovery approach.

Richard J. Marhöfer, Frank Oellien, Paul M Selzer, 2013, Journal of medicinal chemistry.

Screening approaches towards trypanothione reductase.

Frank Oellien, P. Selzer, R. Krauth-Siegel, 2013 .

A combined application of reaction prediction and infrared spectra simulation for the identification of degradation products of s-triazine herbicides.

J Gasteiger, J. Gasteiger, P. Selzer, 2001, Chemistry.

Trypanothione Reductase: A Target Protein for a Combined In Vitro and In Silico Screening Approach

Frank Oellien, P. Selzer, R. Krauth-Siegel, 2015, PLoS neglected tropical diseases.

Antiparasitic and antibacterial drug discovery

P. Selzer, 2009 .

Relationships between Molecular Complexity, Biological Activity, and Structural Diversity

Peter Ertl, Nathan Brown, Edgar Jacoby, 2006, J. Chem. Inf. Model..

Eimeria tenella: identification of secretory and surface proteins from expressed sequence tags.

Richard J. Marhöfer, P. Selzer, C. Klotz, 2005, Experimental parasitology.

Drug Discovery World Fall 2000 45 Informatics web-based cheminformatics for bench chemists

Peter Ertl, Bernhard Rohde, P. Selzer, 2000 .

Chronic arsenic poisoning masquerading as pernicious anemia.

P. Selzer, M. Ancel, 1983, The Western journal of medicine.

Applied Bioinformatics: An Introduction

Paul M. Selzer, A. Rohwer, R. J. Marhfer, 2008 .

Identification of M. tuberculosis thioredoxin reductase inhibitors based on high-throughput docking using constraints.

Oliver Koch, Leopold Flohé, Paul M Selzer, 2013, Journal of medicinal chemistry.

Estimation of pKa for Druglike Compounds Using Semiempirical and Information-Based Descriptors

Peter Ertl, Paul Selzer, Stephen P. Jelfs, 2007, J. Chem. Inf. Model..

The response of Mannheimia haemolytica to iron limitation: implications for the acquisition of iron in the bovine lung.

S. C. Roehrig, P. Selzer, N. Gunkel, 2007, Veterinary microbiology.

Web-based cheminformatics tools deployed via corporate Intranets

Paul M. Selzer, Peter Ertl, Jörg Mühlbacher, 2004 .

Microarray analysis of Haemophilus parasuis gene expression under in vitro growth conditions mimicking the in vivo environment.

P. Selzer, M. Duszenko, N. Gunkel, 2005, Veterinary microbiology.

Antimicrobial Preservatives for Protein and Peptide Formulations: An Overview

Richard J. Marhöfer, P. Selzer, P. Garidel, 2023, Pharmaceutics.

Benchmarking of Multivariate Similarity Measures for High-Content Screening Fingerprints in Phenotypic Drug Discovery

Xian Zhang, Daniela Gabriel, Paul Selzer, 2013, Journal of biomolecular screening.

Chemical Information in 3D Space

Johann Gasteiger, Jens Sadowski, Paul Selzer, 1996, J. Chem. Inf. Comput. Sci..

The Coding of the Three-Dimensional Structure of Molecules by Molecular Transforms and Its Application to Structure-Spectra Correlations and Studies of Biological Activity

Johann Gasteiger, Paul Selzer, Jan H. Schuur, 1996, J. Chem. Inf. Comput. Sci..

A Comparative Chemogenomics Strategy to Predict Potential Drug Targets in the Metazoan Pathogen, Schistosoma mansoni

Richard J. Marhöfer, Paul M. Selzer, Frank Oellien, 2009, PloS one.

A novel cultivation technique for long-term maintenance of bloodstream form trypanosomes in vitro.

P. Selzer, F. Hesse, M. Duszenko, 1995, Molecular and biochemical parasitology.

A single in vivo‐selected point mutation in the active center of Toxoplasma gondii ferredoxin‐NADP+ reductase leads to an inactive enzyme with greatly enhanced affinity for ferredoxin

J. Cramer, P. Selzer, G. Zanetti, 2004, FEBS letters.

Dirofilariasis mouse models for heartworm preclinical research

P. Selzer, C. Wilson, F. Gusovsky, 2023, Frontiers in Microbiology.

Filarial DAF-12 sense the host serum to resume iL3 development during infection

P. Selzer, D. Concordet, R. Prichard, 2023, PLoS Pathogens.