Barbara Zdrazil

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 25

Top Topics

Machine Learning

Top Venues

Journal of cheminformatics

Journal of medicinal chemistry

Journal of chemical information and modeling

Drug metabolism and disposition: the biological fate of chemicals

This page only lists publications with an associated author ORCID identifier.

Publications

Barbara Zdrazil, Rajarashi Guha, Karina Martinez-Mayorga, Nina Jeliazkova
Are new ideas harder to find? A note on incremental research and Journal of Cheminformatics' Scientific Contribution Statement. Journal of cheminformatics 16 (1) (2024)
A Lina Heinzke, Axel Pahl, Barbara Zdrazil, Andrew R Leach, Herbert Waldmann, Robert J Young, Paul D Leeson
Occurrence of "Natural Selection" in Successful Small Molecule Drug Discovery. Journal of medicinal chemistry 67 (13) (2024)
A Lina Heinzke, Axel Pahl, Barbara Zdrazil, Andrew R Leach, Herbert Waldmann, Robert J Young, Paul D Leeson
Occurrence of "Natural Selection" in Successful Small Molecule Drug Discovery. Journal of medicinal chemistry 67 (13) (2024)
A Lina Heinzke, Axel Pahl, Barbara Zdrazil, Andrew R Leach, Herbert Waldmann, Robert J Young, Paul D Leeson
Occurrence of "Natural Selection" in Successful Small Molecule Drug Discovery. Journal of medicinal chemistry 67 (13) (2024)
Barbara Zdrazil, Rajarashi Guha, Karina Martinez-Mayorga, Nina Jeliazkova
Are new ideas harder to find? A note on incremental research and Journal of Cheminformatics' Scientific Contribution Statement. Journal of cheminformatics 16 (1) (2024)
A Lina Heinzke, Axel Pahl, Barbara Zdrazil, Andrew R Leach, Herbert Waldmann, Robert J Young, Paul D Leeson
Occurrence of "Natural Selection" in Successful Small Molecule Drug Discovery. Journal of medicinal chemistry 67 (13) (2024)
Barbara Zdrazil, Rajarashi Guha, Karina Martinez-Mayorga, Nina Jeliazkova
Are new ideas harder to find? A note on incremental research and Journal of Cheminformatics' Scientific Contribution Statement. Journal of cheminformatics 16 (1) (2024)
A Lina Heinzke, Axel Pahl, Barbara Zdrazil, Andrew R Leach, Herbert Waldmann, Robert J Young, Paul D Leeson
Occurrence of "Natural Selection" in Successful Small Molecule Drug Discovery. Journal of medicinal chemistry (2024)
Charles Tapley Hoyt, Barbara Zdrazil, Rajarashi Guha, Nina Jeliazkova, Karina Martinez-Mayorga, Eva Nittinger
Improving reproducibility and reusability in the Journal of Cheminformatics. Journal of cheminformatics 15 (1) (2023)
Barbara Zdrazil, Eloy Felix, Fiona Hunter, Emma J Manners, James Blackshaw, Sybilla Corbett, Marleen de Veij, Harris Ioannidis, David Mendez Lopez, Juan F Mosquera, Maria Paula Magarinos, Nicolas Bosc, Ricardo Arcila, Tevfik Kizilören, Anna Gaulton, A Patrícia Bento, Melissa F Adasme, Peter Monecke, Gregory A Landrum, Andrew R Leach
The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic acids research (2023)
Michael W Mullowney, Katherine R Duncan, Somayah S Elsayed, Neha Garg, Justin Johan Jozias van der Hooft, Nathaniel I Martin, David Meijer, Barbara R Terlouw, Friederike Biermann, Kai Blin, Janani Durairaj, Marina Gorostiola González, Eric J N Helfrich, Florian Huber, Stefan Leopold-Messer, Kohulan Rajan, Tristan de Rond, Jeffrey A van Santen, Maria Sorokina, Marcy J Balunas, Mehdi A Beniddir, Doris A van Bergeijk, Laura M Carroll, Chase M Clark, Djork-Arné Clevert, Chris A Dejong, Chao Du, Scarlet Ferrinho, Francesca Grisoni, Albert Hofstetter, Willem Jespers, Olga V Kalinina, Satria A Kautsar, Hyun Woo Kim, Tiago F Leao, Joleen Masschelein, Evan R Rees, Raphael Reher, Daniel Reker, Philippe Schwaller, Marwin Segler, Michael A Skinnider, Allison S Walker, Egon L Wilighagen, Barbara Zdrazil, Nadine Ziemert, Rebecca J M Goss, Pierre Guyomard, Andrea Volkamer, William H Gerwick, Hyun Uk Kim, Daniel Krug, Gilles P van Wezel, Gerard van Westen, Anna Katharina Herta Hirsch, Roger G Linington, Serina L Robinson, Marnix H Medema
Artificial intelligence for natural product drug discovery. Nature reviews. Drug discovery (2023)
Marvin Martens, Rob Stierum, Emma L Schymanski, Chris T A Evelo, Reza Aalizadeh, Hristo Aladjov, Katarzyna Arturi, Karine Audouze, Pavel Babica, Karel Berka, Jos Bessems, Ludek Blaha, Evan E Bolton, Montserrat Cases, Dimitrios E Damalas, Kirtan Dave, Marco Dilger, Thomas Exner, Daan P Geerke, Roland Grafström, Alasdair Gray, John M Hancock, Henner Hollert, Nina Jeliazkova, Danyel G J Jennen, Fabien Jourdan, Pascal Kahlem, Jana Klanova, Jos Kleinjans, Todor Kondic, Boï Kone, Iseult Lynch, Uko Maran, Sergio Martinez Cuesta, Hervé Ménager, Steffen Neumann, Penny Nymark, Herbert Oberacher, Noelia Ramirez, Sylvie Remy, Philippe Rocca-Serra, Reza M Salek, Brett Sallach, Susanna-Assunta Sansone, Ferran Sanz, Haralambos Sarimveis, Sirarat Sarntivijai, Tobias Schulze, Jaroslav Slobodnik, Ola Spjuth, Jonathan Tedds, Nikolaos Thomaidis, Ralf J M Weber, Gerard van Westen, Craig E Wheelock, Antony J Williams, Hilda Witters, Barbara Zdrazil, Anze Zupanic, Egon L Wilighagen
ELIXIR and Toxicology: a community in development. F1000Research 10 (2023)
Charles Tapley Hoyt, Barbara Zdrazil, Rajarashi Guha, Nina Jeliazkova, Karina Martinez-Mayorga, Eva Nittinger
Improving reproducibility and reusability in the Journal of Cheminformatics. Journal of cheminformatics 15 (1) (2023)
Charles Tapley Hoyt, Barbara Zdrazil, Rajarashi Guha, Nina Jeliazkova, Karina Martinez-Mayorga, Eva Nittinger
Improving reproducibility and reusability in the Journal of Cheminformatics. Journal of cheminformatics 15 (1) (2023)
Alzbeta Tuerkova, Brandon J Bongers, Ulf Norinder, Orsolya Ungvári, Virág Székely, Andrey Tarnovskiy, Gergely Szakács, Csilla Özvegy-Laczka, Gerard van Westen, Barbara Zdrazil
Identifying Novel Inhibitors for Hepatic Organic Anion Transporting Polypeptides by Machine Learning-Based Virtual Screening. Journal of chemical information and modeling (2022)
Alzbeta Tuerkova, Orsolya Ungvári, Réka Laczkó-Rigó, Erzsébet Mernyák, Gergely Szakács, Csilla Özvegy-Laczka, Barbara Zdrazil
Data-Driven Ensemble Docking to Map Molecular Interactions of Steroid Analogs with Hepatic Organic Anion Transporting Polypeptides. Journal of chemical information and modeling 61 (6) (2021)
Rajarashi Guha, Egon L Wilighagen, Barbara Zdrazil, Nina Jeliazkova
What is the role of cheminformatics in a pandemic? Journal of cheminformatics 13 (1) (2021)
Rajarashi Guha, Nina Jeliazkova, Egon L Wilighagen, Barbara Zdrazil
Reply to "FAIR chemical structure in the Journal of Cheminformatics". Journal of cheminformatics 13 (1) (2021)
Marleen J Meyer, Alzbeta Tuerkova, Sarah Römer, Christoph Wenzel, Tina Seitz, Jochen Gaedcke, Stefan Oswald, Jürgen Brockmöller, Barbara Zdrazil, Mladen Vassilev Tzvetkov
Differences in Metformin and Thiamine Uptake between Human and Mouse Organic Cation Transporter 1: Structural Determinants and Potential Consequences for Intrahepatic Concentrations. Drug metabolism and disposition: the biological fate of chemicals 48 (12) (2020)
Sankalp Jain, Ulf Norinder, Sylvia E Escher, Barbara Zdrazil
Combining In Vivo Data with In Silico Predictions for Modeling Hepatic Steatosis by Using Stratified Bagging and Conformal Prediction. Chemical research in toxicology 34 (2) (2020)
Alzbeta Tuerkova, Barbara Zdrazil
A ligand-based computational drug repurposing pipeline using KNIME and Programmatic Data Access: case studies for rare diseases and COVID-19. Journal of cheminformatics 12 (2020)
Alzbeta Tuerkova, Barbara Zdrazil
A ligand-based computational drug repurposing pipeline using KNIME and Programmatic Data Access: case studies for rare diseases and COVID-19. Journal of cheminformatics 12 (1) (2020)
Marleen J Meyer, Viktoria E Neumann, Hannah Rosa Friesacher, Barbara Zdrazil, Jürgen Brockmöller, Mladen Vassilev Tzvetkov
Opioids as Substrates and Inhibitors of the Genetically Highly Variable Organic Cation Transporter OCT1. Journal of medicinal chemistry 62 (21) (2019)
Alžběta Türková, Sankalp Jain, Barbara Zdrazil
Integrative Data Mining, Scaffold Analysis, and Sequential Binary Classification Models for Exploring Ligand Profiles of Hepatic Organic Anion Transporting Polypeptides. Journal of chemical information and modeling 59 (5) (2018)
Barbara Zdrazil, Rajarshi Guha
The Rise and Fall of a Scaffold: A Trend Analysis of Scaffolds in the Medicinal Chemistry Literature. Journal of medicinal chemistry 61 (11) (2017)