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7 results in Authors: Rıza Özçelik

Theoretical and Computational Chemistry

Review

Generative deep learning for de novo drug design – a chemical space odyssey

Rıza Özçelik, Helena Brinkmann, Emanuele Criscuolo, Francesca Grisoni

Version 2 posted 02 April 2025

557

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Theoretical and Computational Chemistry

Working Paper

Deep Supramolecular Language Processing for Co-crystal Prediction

Rebecca Birolo, Rıza Özçelik, Andrea Aramini, Roberto Gobetto, Michele Remo Chierotti, Francesca Grisoni

Version 3 posted 27 November 2024

969

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Citations

Theoretical and Computational Chemistry

Review

Deep learning for low-data drug discovery: hurdles and opportunities

Derek van Tilborg, Helena Brinkmann, Emanuele Criscuolo, Luke Rossen, Rıza Özçelik, Francesca Grisoni

Version 1 posted 25 January 2024

1,419

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Citations

Theoretical and Computational Chemistry

Working Paper

The surprising ineffectiveness of molecular dynamics coordinates for predicting bioactivity with machine learning

Emanuele Criscuolo, Rıza Özçelik, Derek van Tilborg, Francesca Grisoni

Version 1 posted 18 December 2024

626

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Theoretical and Computational Chemistry

Working Paper

Chemical Language Modeling with Structured State Spaces

Rıza Özçelik, Sarah de Ruiter, Emanuele Criscuolo, Francesca Grisoni

Version 2 posted 25 January 2024

2,300

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Theoretical and Computational Chemistry

Working Paper

peptidy: A light-weight Python library for peptide representation in machine learning

Rıza Özçelik, Laura van Weesep, Sarah de Ruiter, Francesca Grisoni

Version 2 posted 09 January 2025

707

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Theoretical and Computational Chemistry

Working Paper

Identifying 14-3-3 interactome binding sites with deep learning

Laura van Weesep, Rıza Özçelik, Marloes Pennings, Emanuele Criscuolo, Christian Ottmann, Luc Brunsveld, Francesca Grisoni

Version 1 posted 03 April 2025

192

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7 results in Rıza Özçelik in Authors: Rıza Özçelik

Generative deep learning for de novo drug design – a chemical space odyssey

Deep Supramolecular Language Processing for Co-crystal Prediction

Deep learning for low-data drug discovery: hurdles and opportunities

The surprising ineffectiveness of molecular dynamics coordinates for predicting bioactivity with machine learning

Chemical Language Modeling with Structured State Spaces

peptidy: A light-weight Python library for peptide representation in machine learning

Identifying 14-3-3 interactome binding sites with deep learning

7 results in Authors: Rıza Özçelik