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Journal Articles
- 2021
[j9]Jon Kapla
, Ismael Rodriguez-Espigares, Flavio Ballante, Jana Selent, Jens Carlsson:
Can molecular dynamics simulations improve the structural accuracy and virtual screening performance of GPCR models? PLoS Comput. Biol. 17(5) (2021)- 2016
- [j8]Flavio Ballante, Garland R. Marshall:
An Automated Strategy for Binding-Pose Selection and Docking Assessment in Structure-Based Drug Design. J. Chem. Inf. Model. 56(1): 54-72 (2016) - 2015
- [j7]Rino Ragno, Flavio Ballante, Adele Pirolli, Richard B. Wickersham III, Alexandros Patsilinakos, Stéphanie Hesse, Enrico Perspicace, Gilbert Kirsch:
Vascular endothelial growth factor receptor-2 (VEGFR-2) inhibitors: development and validation of predictive 3-D QSAR models through extensive ligand- and structure-based approaches. J. Comput. Aided Mol. Des. 29(8): 757-776 (2015) - 2014
- [j6]Flavio Ballante, Antonia Caroli, Richard B. Wickersham III, Rino Ragno:
Hsp90 Inhibitors, Part 1: Definition of 3-D QSAutogrid/R Models as a Tool for Virtual Screening. J. Chem. Inf. Model. 54(3): 956-969 (2014) - [j5]Antonia Caroli, Flavio Ballante, Richard B. Wickersham III, Federico Corelli, Rino Ragno:
Hsp90 Inhibitors, Part 2: Combining Ligand-Based and Structure-Based Approaches for Virtual Screening Application. J. Chem. Inf. Model. 54(3): 970-977 (2014) - 2013
- [j4]Laura Friggeri, Flavio Ballante, Rino Ragno, Ira Musmuca, Daniela de Vita, Fabrizio Manetti, Mariangela Biava, Luigi Scipione, Roberto Di Santo, Roberta Costi, Marta Feroci, Silvano Tortorella:
Pharmacophore Assessment Through 3-D QSAR: Evaluation of the Predictive Ability on New Derivatives by the Application on a Series of Antitubercular Agents. J. Chem. Inf. Model. 53(6): 1463-1474 (2013) - 2012
- [j3]Flavio Ballante, Ira Musmuca, Garland R. Marshall, Rino Ragno:
Comprehensive model of wild-type and mutant HIV-1 reverse transciptases. J. Comput. Aided Mol. Des. 26(8): 907-919 (2012) - [j2]Flavio Ballante, Rino Ragno:
3-D QSAutogrid/R: An Alternative Procedure To Build 3-D QSAR Models. Methodologies and Applications. J. Chem. Inf. Model. 52(6): 1674-1685 (2012) - [j1]Laura Silvestri, Flavio Ballante, Antonello Mai, Garland R. Marshall, Rino Ragno:
Histone Deacetylase Inhibitors: Structure-Based Modeling and Isoform-Selectivity Prediction. J. Chem. Inf. Model. 52(8): 2215-2235 (2012)
Coauthor Index
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