Eva Nittinger (E Nittinger)

Loop profile ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 13

Top Venues

Journal of cheminformatics

Journal of chemical information and modeling

Nature communications

ACS omega

Universität Hamburg

Universität Hamburg (BSC)

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

Affiliation History

Universität Hamburg Mar 01 2018 - Aug 15 2019

Germany

PostDoc :: ZBH - Center for Bioinformatics

Education History

Universität Hamburg

Germany

BSC

Publications

Alessandro Tibo, Jiazhen He, Jon Paul Janet, Eva Nittinger, Ola Engkvist
Exhaustive local chemical space exploration using a transformer model. Nature communications 15 (1) (2024)
Alessandro Tibo, Jiazhen He, Jon Paul Janet, Eva Nittinger, Ola Engkvist
Exhaustive local chemical space exploration using a transformer model. Nature communications 15 (1) (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)
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)
Karolina Kwapien, Eva Nittinger, Jiazhen He, Christian Margreitter, Alexey Voronov, Christian Tyrchan
Implications of Additivity and Nonadditivity for Machine Learning and Deep Learning Models in Drug Design. ACS omega 7 (30) (2022)
D Gogishvili, Eva Nittinger, C Margreitter, C Tyrchan
Nonadditivity in public and inhouse data: implications for drug design. Journal of cheminformatics 13 (1) (2021)
Daniel Fernández-Llaneza, Silas Ulander, Dea Gogishvili, Eva Nittinger, Hongtao Zhao, Christian Tyrchan
Siamese Recurrent Neural Network with a Self-Attention Mechanism for Bioactivity Prediction. ACS omega 6 (16) (2021)
Eva Nittinger, Paul Gibbons, Charles Eigenbrot, Doug R Davies, Brigitte Maurer, Christine L Yu, James R Kiefer, Andreas Kuglstatter, Jeremy Murray, Daniel F Ortwine, Yong Tang, Vickie Tsui
Water molecules in protein-ligand interfaces. Evaluation of software tools and SAR comparison. Journal of computer-aided molecular design 33 (3) (2019)
Eva Nittinger, Florian Flachsenberg, Stefan Bietz, Gudrun Lange, Robert Klein, Matthias Rarey
Placement of Water Molecules in Protein Structures: From Large-Scale Evaluations to Single-Case Examples. Journal of chemical information and modeling 58 (8) (2018)
Eva Nittinger, Therese Inhester, Stefan Bietz, Agnes Meyder, Karen T Schomburg, Gudrun Lange, Robert Klein, Matthias Rarey
Large-Scale Analysis of Hydrogen Bond Interaction Patterns in Protein-Ligand Interfaces. Journal of medicinal chemistry 60 (10) (2017)
Agnes Meyder, Eva Nittinger, Gudrun Lange, Robert Klein, Matthias Rarey
Estimating Electron Density Support for Individual Atoms and Molecular Fragments in X-ray Structures. Journal of chemical information and modeling 57 (10) (2017)
Therese Inhester, Eva Nittinger, Kai Sommer, Pascal Schmidt, Stefan Bietz, Matthias Rarey
NAOMInova: Interactive Geometric Analysis of Noncovalent Interactions in Macromolecular Structures. Journal of chemical information and modeling 57 (9) (2017)

Eva Nittinger.css-eqlu8i{font-size:small;padding-left:4px;} (E Nittinger)

Publication Activity (10 Years)

Top Topics

Top Venues

Eva Nittinger (E Nittinger)