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Károly Héberger
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2020 – today
- 2024
- [j11]Károly Héberger
:
Frequent Errors in Modeling by Machine Learning: A Prototype Case of Predicting the Timely Evolution of COVID-19 Pandemic. Algorithms 17(1): 43 (2024) - 2022
- [j10]Anita Rácz, Timothy B. Dunn, Dávid Bajusz, Taewon David Kim, Ramón Alain Miranda-Quintana
, Károly Héberger:
Extended continuous similarity indices: theory and application for QSAR descriptor selection. J. Comput. Aided Mol. Des. 36(3): 157-173 (2022) - [j9]Anita Rácz
, Levente M. Mihalovits
, Dávid Bajusz
, Károly Héberger
, Ramón Alain Miranda-Quintana
:
Molecular Dynamics Simulations and Diversity Selection by Extended Continuous Similarity Indices. J. Chem. Inf. Model. 62(14): 3415-3425 (2022) - 2021
- [j8]Ramón Alain Miranda-Quintana
, Dávid Bajusz
, Anita Rácz
, Károly Héberger
:
Extended similarity indices: the benefits of comparing more than two objects simultaneously. Part 1: Theory and characteristics†. J. Cheminformatics 13(1): 32 (2021) - [j7]Ramón Alain Miranda-Quintana
, Anita Rácz
, Dávid Bajusz
, Károly Héberger
:
Extended similarity indices: the benefits of comparing more than two objects simultaneously. Part 2: speed, consistency, diversity selection. J. Cheminformatics 13(1): 33 (2021)
2010 – 2019
- 2018
- [j6]Anita Rácz
, Dávid Bajusz
, Károly Héberger
:
Life beyond the Tanimoto coefficient: similarity measures for interaction fingerprints. J. Cheminformatics 10(1): 48:1-48:12 (2018) - 2015
- [j5]Dávid Bajusz
, Anita Rácz, Károly Héberger:
Why is Tanimoto index an appropriate choice for fingerprint-based similarity calculations? J. Cheminformatics 7: 20:1-20:13 (2015) - 2013
- [j4]Gergely Tóth
, Zsolt Bodai
, Károly Héberger:
Estimation of influential points in any data set from coefficient of determination and its leave-one-out cross-validated counterpart. J. Comput. Aided Mol. Des. 27(10): 837-844 (2013)
2000 – 2009
- 2005
- [j3]Orsolya Farkas, Károly Héberger:
Comparison of Ridge Regression, Partial Least-Squares, Pairwise Correlation, Forward- and Best Subset Selection Methods for Prediction of Retention Indices for Aliphatic Alcohols. J. Chem. Inf. Model. 45(2): 339-346 (2005) - 2003
- [j2]Rozália Vanyúr, Károly Héberger, Judit Jakus:
Prediction of Anti-HIV-1 Activity of a Series of Tetrapyrrole Molecules. J. Chem. Inf. Comput. Sci. 43(6): 1829-1836 (2003) - 2002
- [j1]András Németh, Tamás Vidóczy, Károly Héberger, Zsolt Kúti, János Wágner:
MECHGEN: Computer Aided Generation and Reduction of Reaction Mechanisms. J. Chem. Inf. Comput. Sci. 42(2): 208-214 (2002) - 2000
- [c1]Rozália Vanyúr, Károly Héberger, István Kövesdi, Judit Jakus:
Prediction of Photosensitizers Activity in Photodynamic Therapy Using Artificial Neural Networks: A 3D - QSAR Study. ANNIMAB 2000: 295-300
Coauthor Index

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