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6 results in Authors: Federico Zipoli

Theoretical and Computational Chemistry

Automated Extraction of Chemical Synthesis Actions from Experimental Procedures

Alain C. Vaucher, Federico Zipoli, Joppe Geluykens, Vishnu H Nair, Philippe Schwaller, Teodoro Laino

Version 2 posted 10 April 2020

1,924

Downloads

Integrating Genetic Algorithms and Language Models for Enhanced Enzyme Design

Yves Gaetan Nana Teukam, Federico Zipoli, Teodoro Laino, Emanuele Criscuolo, Francesca Grisoni, Matteo Manica

Version 1 posted 13 March 2024

1,470

Downloads

1

Citations

Analytical Chemistry

Learning the Language of NMR: Structure Elucidation from NMR spectra using Transformer Models

Marvin Alberts, Federico Zipoli, Alain C. Vaucher

Version 1 posted 14 August 2023

3,629

Downloads

8

Citations

Theoretical and Computational Chemistry

Growing strings in a chemical reaction space for searching retrosynthesis pathways

Federico Zipoli, Carlo Baldassari, Matteo Manica, Jannis Born, Teodoro Laino

Version 1 posted 17 August 2023

328

Downloads

Analytical Chemistry

Setting New Benchmarks in AI-driven Infrared Structure Elucidation

Marvin Alberts, Federico Zipoli, Teodoro Laino

Version 1 posted 02 April 2025

338

Downloads

Inorganic Chemistry

IR–NMR Multimodal Computational Spectra Dataset for 177K Patent-Extracted Organic Molecules

Federico Zipoli, Marvin Alberts, Teodoro Laino

Version 1 posted 19 June 2025

78

Downloads