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Bioinformatics (Oxford, England)|March 20, 2018
ADPredict: ADP-ribosylation site prediction based on physicochemical and structural descriptorsMatteo Lo Monte, Candida Manelfi, Marica Gemei, et al.International Journal of Molecular Sciences|March 29, 2020
Combining Molecular Dynamics and Docking Simulations to Develop Targeted Protocols for Performing Optimized Virtual Screening Campaigns on The hTRPM8 ChannelCarmine Talarico, Silvia Gervasoni, Candida Manelfi, et al.International Journal of Molecular Sciences|July 27, 2022
Extensive Sampling of Molecular Dynamics Simulations to Identify Reliable Protein Structures for Optimized Virtual Screening Studies: The Case of the hTRPM8 ChannelSilvia Gervasoni, Carmine Talarico, Candida Manelfi, et al.Cells|September 23, 2022
Computational Insights into the Sequence-Activity Relationships of the NGF(1-14) Peptide by Molecular Dynamics SimulationsSerena Vittorio, Candida Manelfi, Silvia Gervasoni, et al.Journal of Cheminformatics|July 24, 2021
"Molecular Anatomy": a new multi-dimensional hierarchical scaffold analysis toolCandida Manelfi, Marica Gemei, Carmine Talarico, et al.International Journal of Molecular Sciences|January 11, 2024
Target Prediction by Multiple Virtual Screenings: Analyzing the SARS-CoV-2 Phenotypic Screening by the Docking Simulations Submitted to the MEDIATE InitiativeSilvia Gervasoni, Candida Manelfi, Sara Adobati, et al.Scientific Reports|December 12, 2018
CASP4 gene silencing in epithelial cancer cells leads to impairment of cell migration, cell-matrix adhesion and tissue invasionGiuliana Papoff, Dario Presutti, Cristiana Lalli, et al.Molecules (Basel, Switzerland)|March 27, 2025
Integrating Surface Plasmon Resonance and Docking Analysis for Mechanistic Insights of Tryptase InhibitorsAlessia Porta, Candida Manelfi, Carmine Talarico, et al.International Journal of Molecular Sciences|August 1, 2020
Computational Studies of SARS-CoV-2 3CLpro: Insights from MD SimulationsAlessandro Grottesi, Neva Bešker, Andrew Emerson, et al.Journal of Cheminformatics|February 23, 2024
"DompeKeys": a set of novel substructure-based descriptors for efficient chemical space mapping, development and structural interpretation of machine learning models, and indexing of large databasesCandida Manelfi, Valerio Tazzari, Filippo Lunghini, et al.Pageof 3