Showing results (21-30 of 76) with videos related to
Sort By:
Pageof 8
Chemmedchem|April 12, 2019
Design of Natural-Product-Inspired Multitarget Ligands by Machine LearningFrancesca Grisoni, Daniel Merk, Lukas Friedrich, et al.Molecular Informatics|August 25, 2018
On the Misleading Use of for QSAR Model ComparisonViviana Consonni, Roberto Todeschini, Davide Ballabio, et al.Journal of Chemical Information and Modeling|February 22, 2022
Perplexity-Based Molecule Ranking and Bias Estimation of Chemical Language ModelsMichael Moret, Francesca Grisoni, Paul Katzberger, et al.Journal of Chemical Information and Modeling|January 7, 2020
Bidirectional Molecule Generation with Recurrent Neural NetworksFrancesca Grisoni, Michael Moret, Robin Lingwood, et al.Molecular Informatics|December 15, 2018
Integrated QSAR Models to Predict Acute Oral Systemic ToxicityDavide Ballabio, Francesca Grisoni, Viviana Consonni, et al.Integrated Environmental Assessment and Management|February 20, 2018
Predictive Models in Ecotoxicology: Bridging the Gap Between Scientific Progress and Regulatory ApplicabilityAndreas Focks, Francesca Grisoni, Alpar Barsi, et al.Journal of Chemical Information and Modeling|July 9, 2025
Generative Deep Learning for de Novo Drug Design─A Chemical Space OdysseyRıza Özçelik, Helena Brinkmann, Emanuele Criscuolo, et al.Chemical Communications (Cambridge, England)|September 11, 2025
Enhancing deep chemical reaction prediction with advanced chirality and fragment representationFabrizio Mastrolorito, Fulvio Ciriaco, Orazio Nicolotti, et al.Integrated Environmental Assessment and Management|March 2, 2019
Predictive models in ecotoxicology: Bridging the gap between scientific progress and regulatory applicability-Remarks and research needsMarco Vighi, Alpar Barsi, Andreas Focks, et al.Journal of Chemical Information and Modeling|June 26, 2025
Scaffold Hopping with Generative Reinforcement LearningLuke Rossen, Finton Sirockin, Nadine Schneider, et al.Pageof 8