MASTROLORITO, FABRIZIO
MASTROLORITO, FABRIZIO
1-Oxa-2,6-Diazaspiro[3.3]heptane as a New Potential Piperazine Bioisostere – Flow-Assisted Preparation and Derivatisation by Strain-Release of Azabicyclo[1.1.0]butanes
2024-01-01 Graziano, Elena; Natho, Philipp; Andresini, Michael; Mastrolorito, Fabrizio; Mahdi, Iktedar; Mesto, Ernesto; Colella, Marco; Degennaro, Leonardo; Nicolotti, Orazio; Luisi, Renzo
Chemical Space Networks Enhance Toxicity Recognition via Graph Embedding
2025-01-01 Mastrolorito, F.; Gambacorta, N.; Ciriaco, F.; Cutropia, F.; Togo, Maria Vittoria; Belgiovine, V.; Tondo, A. R.; Trisciuzzi, D.; Monaco, A.; Bellotti, R.; Altomare, C. D.; Nicolotti, O.; Amoroso, N.
CUPID: A free drug discovery platform for the explainable multi-ion channel assessment of cardiotoxicity
2025-01-01 Gambacorta, Nicola; Mastrolorito, Fabrizio; Togo, Maria Vittoria; Amenduni, Vincenzo; Mele, Marco; Liantonio, Antonella; Mele, Antonietta; De Luca, Annamaria; Altomare, Cosimo Damiano; Belgiovine, Valentina; Tondo, Anna Rita; Cutropia, Francesca; Siragusa, Lydia; Amoroso, Nicola; Ciriaco, Fulvio; Imbrici, Paola; Trisciuzzi, Daniela; Nicolotti, Orazio
Enhancing deep chemical reaction prediction with advanced chirality and fragment representation
2025-01-01 Mastrolorito, Fabrizio; Ciriaco, Fulvio; Nicolotti, Orazio; Grisoni, Francesca
fragSMILES as a chemical string notation for advanced fragment and chirality representation
2025-01-01 Mastrolorito, Fabrizio; Ciriaco, Fulvio; Togo, Maria Vittoria; Gambacorta, Nicola; Trisciuzzi, Daniela; Altomare, Cosimo Damiano; Amoroso, Nicola; Grisoni, Francesca; Nicolotti, Orazio
Machine learning resources for drug design
2023-01-01 Gambacorta, N.; Trisciuzzi, D.; Ciriaco, F.; Mastrolorito, F.; Togo, M. V.; Tondo, A. R.; Altomare, C. D.; Amoroso, N.; Nicolotti, O.
Making sense of chemical space network shows signs of criticality
2023-01-01 Amoroso, N.; Gambacorta, N.; Mastrolorito, F.; Togo, M. V.; Trisciuzzi, D.; Monaco, A.; Pantaleo, E.; Altomare, C. D.; Ciriaco, F.; Nicolotti, O.
Novel Sulfonium Reagents for the Modular Synthesis of Spiro[2.3]Hexanes and Heteroatom‐Containing Analogues: Synthesis, Application, and Evaluation as Bioisosteres
2026-01-01 Natho, Philipp; Vicenti, Annarita; Mastrolorito, Fabrizio; De Franco, Francesca; Walsh‐benn, Lee; Colella, Marco; Mesto, Ernesto; Schingaro, Emanuela; Nicolotti, Orazio; Gioiello, Antimo; Luisi, Renzo
PoseidonQ: A Free Machine Learning Platform for the Development, Analysis, and Validation of Efficient and Portable QSAR Models for Drug Discovery
2025-01-01 Kabier, Muzammil; Gambacorta, Nicola; Ciriaco, Fulvio; Mastrolorito, Fabrizio; Kumar, Sunil; Mathew, Bijo; Nicolotti, Orazio
TIRESIA and TISBE: Explainable Artificial Intelligence Based Web Platforms for the Transparent Assessment of the Developmental Toxicity of Chemicals and Drugs
2025-01-01 Togo, Maria Vittoria; Mastrolorito, Fabrizio; Gambacorta, Nicola; Trisciuzzi, Daniela; Tondo, Anna Rita; Cutropia, Francesca; Belgiovine, Valentina; Altomare, Cosimo Damiano; Amoroso, Nicola; Nicolotti, Orazio; Ciriaco, Fulvio
TIRESIA: An eXplainable Artificial Intelligence Platform for Predicting Developmental Toxicity
2023-01-01 Togo, Maria Vittoria; Mastrolorito, Fabrizio; Ciriaco, Fulvio; Trisciuzzi, Daniela; Tondo, Anna Rita; Gambacorta, Nicola; Bellantuono, Loredana; Monaco, Alfonso; Leonetti, Francesco; Bellotti, Roberto; Altomare, Cosimo Damiano; Amoroso, Nicola; Nicolotti, Orazio
TISBE: A Public Web Platform for the Consensus-Based Explainable Prediction of Developmental Toxicity
2024-01-01 Mastrolorito, F.; Togo, M. V.; Gambacorta, N.; Trisciuzzi, D.; Giannuzzi, V.; Bonifazi, F.; Liantonio, A.; Imbrici, P.; De Luca, A.; Altomare, C. D.; Ciriaco, F.; Amoroso, N.; Nicolotti, O.
Where developmental toxicity meets explainable artificial intelligence: state-of-the-art and perspectives
2023-01-01 Vittoria Togo, M; Mastrolorito, F; Orfino, A; Graps, Ea; Tondo, Ar; Altomare, Cd; Ciriaco, F; Trisciuzzi, D; Nicolotti, O; Amoroso, N
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| 1-Oxa-2,6-Diazaspiro[3.3]heptane as a New Potential Piperazine Bioisostere – Flow-Assisted Preparation and Derivatisation by Strain-Release of Azabicyclo[1.1.0]butanes | 1-gen-2024 | Graziano, Elena; Natho, Philipp; Andresini, Michael; Mastrolorito, Fabrizio; Mahdi, Iktedar; Mesto, Ernesto; Colella, Marco; Degennaro, Leonardo; Nicolotti, Orazio; Luisi, Renzo | |
| Chemical Space Networks Enhance Toxicity Recognition via Graph Embedding | 1-gen-2025 | Mastrolorito, F.; Gambacorta, N.; Ciriaco, F.; Cutropia, F.; Togo, Maria Vittoria; Belgiovine, V.; Tondo, A. R.; Trisciuzzi, D.; Monaco, A.; Bellotti, R.; Altomare, C. D.; Nicolotti, O.; Amoroso, N. | |
| CUPID: A free drug discovery platform for the explainable multi-ion channel assessment of cardiotoxicity | 1-gen-2025 | Gambacorta, Nicola; Mastrolorito, Fabrizio; Togo, Maria Vittoria; Amenduni, Vincenzo; Mele, Marco; Liantonio, Antonella; Mele, Antonietta; De Luca, Annamaria; Altomare, Cosimo Damiano; Belgiovine, Valentina; Tondo, Anna Rita; Cutropia, Francesca; Siragusa, Lydia; Amoroso, Nicola; Ciriaco, Fulvio; Imbrici, Paola; Trisciuzzi, Daniela; Nicolotti, Orazio | |
| Enhancing deep chemical reaction prediction with advanced chirality and fragment representation | 1-gen-2025 | Mastrolorito, Fabrizio; Ciriaco, Fulvio; Nicolotti, Orazio; Grisoni, Francesca | |
| fragSMILES as a chemical string notation for advanced fragment and chirality representation | 1-gen-2025 | Mastrolorito, Fabrizio; Ciriaco, Fulvio; Togo, Maria Vittoria; Gambacorta, Nicola; Trisciuzzi, Daniela; Altomare, Cosimo Damiano; Amoroso, Nicola; Grisoni, Francesca; Nicolotti, Orazio | |
| Machine learning resources for drug design | 1-gen-2023 | Gambacorta, N.; Trisciuzzi, D.; Ciriaco, F.; Mastrolorito, F.; Togo, M. V.; Tondo, A. R.; Altomare, C. D.; Amoroso, N.; Nicolotti, O. | |
| Making sense of chemical space network shows signs of criticality | 1-gen-2023 | Amoroso, N.; Gambacorta, N.; Mastrolorito, F.; Togo, M. V.; Trisciuzzi, D.; Monaco, A.; Pantaleo, E.; Altomare, C. D.; Ciriaco, F.; Nicolotti, O. | |
| Novel Sulfonium Reagents for the Modular Synthesis of Spiro[2.3]Hexanes and Heteroatom‐Containing Analogues: Synthesis, Application, and Evaluation as Bioisosteres | 1-gen-2026 | Natho, Philipp; Vicenti, Annarita; Mastrolorito, Fabrizio; De Franco, Francesca; Walsh‐benn, Lee; Colella, Marco; Mesto, Ernesto; Schingaro, Emanuela; Nicolotti, Orazio; Gioiello, Antimo; Luisi, Renzo | |
| PoseidonQ: A Free Machine Learning Platform for the Development, Analysis, and Validation of Efficient and Portable QSAR Models for Drug Discovery | 1-gen-2025 | Kabier, Muzammil; Gambacorta, Nicola; Ciriaco, Fulvio; Mastrolorito, Fabrizio; Kumar, Sunil; Mathew, Bijo; Nicolotti, Orazio | |
| TIRESIA and TISBE: Explainable Artificial Intelligence Based Web Platforms for the Transparent Assessment of the Developmental Toxicity of Chemicals and Drugs | 1-gen-2025 | Togo, Maria Vittoria; Mastrolorito, Fabrizio; Gambacorta, Nicola; Trisciuzzi, Daniela; Tondo, Anna Rita; Cutropia, Francesca; Belgiovine, Valentina; Altomare, Cosimo Damiano; Amoroso, Nicola; Nicolotti, Orazio; Ciriaco, Fulvio | |
| TIRESIA: An eXplainable Artificial Intelligence Platform for Predicting Developmental Toxicity | 1-gen-2023 | Togo, Maria Vittoria; Mastrolorito, Fabrizio; Ciriaco, Fulvio; Trisciuzzi, Daniela; Tondo, Anna Rita; Gambacorta, Nicola; Bellantuono, Loredana; Monaco, Alfonso; Leonetti, Francesco; Bellotti, Roberto; Altomare, Cosimo Damiano; Amoroso, Nicola; Nicolotti, Orazio | |
| TISBE: A Public Web Platform for the Consensus-Based Explainable Prediction of Developmental Toxicity | 1-gen-2024 | Mastrolorito, F.; Togo, M. V.; Gambacorta, N.; Trisciuzzi, D.; Giannuzzi, V.; Bonifazi, F.; Liantonio, A.; Imbrici, P.; De Luca, A.; Altomare, C. D.; Ciriaco, F.; Amoroso, N.; Nicolotti, O. | |
| Where developmental toxicity meets explainable artificial intelligence: state-of-the-art and perspectives | 1-gen-2023 | Vittoria Togo, M; Mastrolorito, F; Orfino, A; Graps, Ea; Tondo, Ar; Altomare, Cd; Ciriaco, F; Trisciuzzi, D; Nicolotti, O; Amoroso, N |