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Ernst Ahlberg Helgee
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2020 – today
- 2024
- [j13]Staffan Arvidsson McShane, Ulf Norinder, Jonathan Alvarsson, Ernst Ahlberg, Lars Carlsson, Ola Spjuth:
CPSign: conformal prediction for cheminformatics modeling. J. Cheminformatics 16(1): 75 (2024) - 2021
- [j12]Staffan Arvidsson McShane, Ernst Ahlberg, Tobias Noeske, Ola Spjuth:
Machine Learning Strategies When Transitioning between Biological Assays. J. Chem. Inf. Model. 61(7): 3722-3733 (2021) - [c11]Vladimir Vovk, Ivan Petej, Ilia Nouretdinov, Ernst Ahlberg, Lars Carlsson, Alex Gammerman:
Retrain or not retrain: conformal test martingales for change-point detection. COPA 2021: 191-210 - [c10]Hugo Werner, Lars Carlsson, Ernst Ahlberg, Henrik Boström:
Evaluation of updating strategies for conformal predictive systems in the presence of extreme events. COPA 2021: 229-242 - [i1]Vladimir Vovk, Ivan Petej, Ilia Nouretdinov, Ernst Ahlberg, Lars Carlsson, Alex Gammerman:
Retrain or not retrain: Conformal test martingales for change-point detection. CoRR abs/2102.10439 (2021) - 2020
- [c9]Vladimir Vovk, Ivan Petej, Paolo Toccaceli, Alexander Gammerman, Ernst Ahlberg, Lars Carlsson:
Conformal calibrators. COPA 2020: 84-99 - [c8]Hugo Werner, Lars Carlsson, Ernst Ahlberg, Henrik Boström:
Evaluating different approaches to calibrating conformal predictive systems. COPA 2020: 134-150
2010 – 2019
- 2019
- [j11]Rubén Buendía, Thierry Kogej, Ola Engkvist, Lars Carlsson, Henrik Linusson, Ulf Johansson, Paolo Toccaceli, Ernst Ahlberg:
Accurate Hit Estimation for Iterative Screening Using Venn-ABERS Predictors. J. Chem. Inf. Model. 59(3): 1230-1237 (2019) - 2018
- [c7]Ernst Ahlberg, Rubén Buendía, Lars Carlsson:
Using Venn-Abers predictors to assess cardio-vascular risk. COPA 2018: 132-146 - [c6]Rubén Buendía, Ola Engkvist, Lars Carlsson, Thierry Kogej, Ernst Ahlberg:
Venn-Abers predictors for improved compound iterative screening in drug discovery. COPA 2018: 201-219 - 2017
- [j10]Ernst Ahlberg, Oscar Hammar, Claus Bendtsen, Lars Carlsson:
Current application of conformal prediction in drug discovery - Two useful applications. Ann. Math. Artif. Intell. 81(1-2): 145-154 (2017) - [j9]Claus Bendtsen, Andrea Degasperi, Ernst Ahlberg, Lars Carlsson:
Improving machine learning in early drug discovery. Ann. Math. Artif. Intell. 81(1-2): 155-166 (2017) - [j8]Jiangming Sun, Lars Carlsson, Ernst Ahlberg, Ulf Norinder, Ola Engkvist, Hongming Chen:
Applying Mondrian Cross-Conformal Prediction To Estimate Prediction Confidence on Large Imbalanced Bioactivity Data Sets. J. Chem. Inf. Model. 57(7): 1591-1598 (2017) - [c5]Ernst Ahlberg, Susanne Winiwarter, Henrik Boström, Henrik Linusson, Tuve Löfström, Ulf Norinder, Ulf Johansson, Ola Engkvist, Oscar Hammar, Claus Bendtsen, Lars Carlsson:
Using Conformal Prediction to Prioritize Compound Synthesis in Drug Discovery. COPA 2017: 174-184 - [c4]Lars Carlsson, Claus Bendtsen, Ernst Ahlberg:
Comparing Performance of Different Inductive and Transductive Conformal Predictors Relevant to Drug Discovery. COPA 2017: 201-212 - 2015
- [c3]Lars Carlsson, Ernst Ahlberg, Henrik Boström, Ulf Johansson, Henrik Linusson:
Modifications to p-Values of Conformal Predictors. SLDS 2015: 251-259 - [c2]Ulf Johansson, Ernst Ahlberg, Henrik Boström, Lars Carlsson, Henrik Linusson, Cecilia Sönströd:
Handling Small Calibration Sets in Mondrian Inductive Conformal Regressors. SLDS 2015: 271-280 - [c1]Ernst Ahlberg, Ola Spjuth, Catrin Hasselgren, Lars Carlsson:
Interpretation of Conformal Prediction Classification Models. SLDS 2015: 323-334 - 2014
- [j7]Ernst Ahlberg Helgee, Lars Carlsson, Scott Boyer:
Computational Derivation of Structural Alerts from Large Toxicology Data Sets. J. Chem. Inf. Model. 54(10): 2945-2952 (2014) - 2013
- [j6]Jonna C. Stålring, Pedro Almeida, Lars Carlsson, Ernst Ahlberg Helgee, Catrin Hasselgren Arnby, Scott Boyer:
Localized Heuristic Inverse Quantitative Structure Activity Relationship with Bulk Descriptors Using Numerical Gradients. J. Chem. Inf. Model. 53(8): 2001-2017 (2013) - 2012
- [j5]Anna Bauer-Mehren, Erik M. van Mulligen, Paul Avillach, María del Carmen Carrascosa, Ricard García-Serna, Janet Piñero González, Bharat Singh, Pedro Lopes, José Luís Oliveira, Gayo Diallo, Ernst Ahlberg Helgee, Scott Boyer, Jordi Mestres, Ferran Sanz, Jan A. Kors, Laura Inés Furlong:
Automatic Filtering and Substantiation of Drug Safety Signals. PLoS Comput. Biol. 8(4) (2012) - 2011
- [j4]Ola Spjuth, Martin Eklund, Ernst Ahlberg Helgee, Scott Boyer, Lars Carlsson:
Integrated Decision Support for Assessing Chemical Liabilities. J. Chem. Inf. Model. 51(8): 1840-1847 (2011) - 2010
- [j3]Ernst Ahlberg Helgee, Lars Carlsson, Scott Boyer, Ulf Norinder:
Evaluation of Quantitative Structure-Activity Relationship Modeling Strategies: Local and Global Models. J. Chem. Inf. Model. 50(4): 677-689 (2010)
2000 – 2009
- 2009
- [j2]Lars Carlsson, Ernst Ahlberg Helgee, Scott Boyer:
Interpretation of Nonlinear QSAR Models Applied to Ames Mutagenicity Data. J. Chem. Inf. Model. 49(11): 2551-2558 (2009) - [j1]Ernst Ahlberg Helgee, Lars Carlsson, Scott Boyer:
A Method for Automated Molecular Optimization Applied to Ames Mutagenicity Data. J. Chem. Inf. Model. 49(11): 2559-2563 (2009)
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