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Papers matching “smiling” 18

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Tweet with a smile: The selection and use of emoji on Twitter in the Netherlands and England
2020 First Monday article Computer Science Digital Communication and Language Open access

Maximilian Roele, Janelle Ward, Max J. van Duijn

9

citations
SMILE: Self-Explainable Multimodal Information Bottleneck for Medical Diagnosis
2026 arXiv (Cornell University) preprint Computer Science Explainable Artificial Intelligence (XAI) Open access

Yuqing Yang, Alexander Schmatz, Zhaozhao Ma, Changkyu Choi, Robert Jenssen, Shujian Yu

0

citations
UnCorrupt SMILES: a novel approach to de novo design
2023 Journal of Cheminformatics article Computer Science Computational Drug Discovery Methods Open access

Linde Schoenmaker, Olivier J. M. Béquignon, Willem Jespers, Gerard J. P. van Westen

38

citations
UnCorrupt SMILES: a novel approach to de novo design
2022 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Linde Schoenmaker, Olivier J. M. Béquignon, Willem Jespers, Gerard J. P. van Westen

3

citations
UnCorrupt SMILES: a novel approach to de novo design
2022 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Linde Schoenmaker, Olivier J. M. Béquignon, Willem Jespers, Gerard J. P. van Westen

3

citations
Solvation Free Energies of Anions: From Curated Reference Data to Predictive Models
2025 Journal of the American Chemical Society article Computer Science Computational Drug Discovery Methods Open access

Thomas Nevolianis, Jonathan Wenyuan Zheng, Simon Müller, Matthias Baumann, Sofja Tshepelevitsh, Ivari Kaljurand, +4 more

11

citations
DrugEx v2: de novo design of drug molecules by Pareto-based multi-objective reinforcement learning in polypharmacology
2021 Journal of Cheminformatics article Computer Science Computational Drug Discovery Methods Open access cited by 1 patent

Xuhan Liu, Kai Ye, Herman van Vlijmen, Michael Emmerich, Adriaan P. IJzerman, Gerard J. P. van Westen

118

citations
DrugEx v3: scaffold-constrained drug design with graph transformer-based reinforcement learning
2023 Journal of Cheminformatics article Computer Science Computational Drug Discovery Methods Open access

Xuhan Liu, Kai Ye, Herman van Vlijmen, Adriaan P. IJzerman, Gerard J. P. van Westen

91

citations
QSPRpred: a Flexible Open-Source Quantitative Structure-Property Relationship Modelling Tool
2024 Journal of Cheminformatics article Computer Science Computational Drug Discovery Methods Open access

Helle W. van den Maagdenberg, Martin Šícho, David Alencar Araripe, Sohvi Luukkonen, Linde Schoenmaker, Michiel Jespers, +7 more

29

citations
DrugEx v3: Scaffold-Constrained Drug Design with Graph Transformer-based Reinforcement Learning
2021 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Xuhan Liu, Kai Ye, Herman van Vlijmen, Adriaan P. IJzerman, Gerard J. P. van Westen

11

citations
MolBar: A Molecular Identifier for Inorganic and Organic Molecules with Full Support of Stereoisomerism
2024 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Nils van Staalduinen, Christoph Bannwarth

3

citations
MolBar: A Molecular Identifier for Inorganic and Organic Molecules with Full Support of Stereoisomerism
2024 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Nils van Staalduinen, Christoph Bannwarth

3

citations
QSPRpred: a Flexible Open-Source Quantitative Structure-Property Relationship Modelling Tool
2024 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Helle W. van den Maagdenberg, Martin Šícho, David Alencar Araripe, Sohvi Luukkonen, Linde Schoenmaker, Michiel Jespers, +7 more

1

citations
DrugEx v2: De Novo Design of Drug Molecule by Pareto-based Multi-Objective Reinforcement Learning in Polypharmacology
2021 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Xuhan Liu, Herman van Vlijmen, Michael Emmerich, Adriaan P. IJzerman, Gerard J. P. van Westen

1

citations
DrugEx v2: De Novo Design of Drug Molecule by Pareto-based Multi-Objective Reinforcement Learning in Polypharmacology
2021 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Xuhan Liu, Kai Ye, Herman van Vlijmen, Michael Emmerich, Adriaan P. IJzerman, Gerard J. P. van Westen

1

citations
Accompanying data - UnCorrupt SMILES: a novel approach to de novo design
2022 Zenodo (CERN European Organization for Nuclear Research) dataset Computer Science Computational Drug Discovery Methods Open access

Linde Schoenmaker, Olivier J.M. Béquignong, Willem Jespers, Gerard J. P. van Westen

0

citations
Accompanying data - UnCorrupt SMILES: a novel approach to de novo design
2022 Zenodo (CERN European Organization for Nuclear Research) dataset Computer Science Computational Drug Discovery Methods Open access

Linde Schoenmaker, Olivier J.M. Béquignong, Willem Jespers, Gerard J. P. van Westen

0

citations
DrugEx v2: De Novo Design of Drug Molecule by Pareto-based Multi-Objective Reinforcement Learning in Polypharmacology
2021 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Xuhan Liu, Herman van Vlijmen, Michael Emmerich, Adriaan P. IJzerman, Gerard J. P. van Westen

0

citations

18 results