Damian Lesniak

Development of New Methods Needs Proper Evaluation - Benchmarking Sets for Machine Learning Experiments for Class A GPCRs

Jacek Tabor, Igor Sieradzki, Stanisław Jastrzębski, 2019, J. Chem. Inf. Model..

How Sure Can We Be about ML Methods-Based Evaluation of Compound Activity: Incorporation of Information about Prediction Uncertainty Using Deep Learning Techniques

Igor Sieradzki, Sabina Podlewska, Damian Leśniak, 2020, Molecules.

Learning to SMILE(S)

Wojciech M. Czarnecki, Stanislaw Jastrzebski, Stanisław Jastrzębski, 2016, ArXiv.

Learning to SMILE(S) pdf

Wojciech Czarnecki, Damian Lesniak, Stanislaw Jastrzebski, 2016, ArXiv.

How to evaluate word embeddings? On importance of data efficiency and simple supervised tasks pdf

Wojciech Czarnecki, Damian Lesniak, Stanislaw Jastrzebski, 2017, ArXiv.

Three-dimensional descriptors for aminergic GPCRs: dependence on docking conformation and crystal structure

Stanislaw Jastrzebski, A. Bojarski, J. Tabor, 2018, Molecular Diversity.

Quo vadis G protein-coupled receptor ligands? A tool for analysis of the emergence of new groups of compounds over time.

Wojciech M. Czarnecki, Stanislaw Jastrzebski, A. Bojarski, 2017, Bioorganic & medicinal chemistry letters.