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Biochemical and Biophysical Research Communications
|
January 20, 2016
Evaluating the stability of pharmacophore features using molecular dynamics simulations
Marcus Wieder, Ugo Perricone, Stefan Boresch, et al.
International Journal of Molecular Sciences
|
February 26, 2022
EMBER-Embedding Multiple Molecular Fingerprints for Virtual Screening
Isabella Mendolia, Salvatore Contino, Giada De Simone, et al.
International Journal of Molecular Sciences
|
July 24, 2021
Support Vector Machine as a Supervised Learning for the Prioritization of Novel Potential SARS-CoV-2 Main Protease Inhibitors
Nedra Mekni, Claudia Coronnello, Thierry Langer, et al.
BMC Bioinformatics
|
October 23, 2025
Unveiling molecular moieties through hierarchical Grad-CAM graph explainability
Salvatore Contino, Paolo Sortino, Maria Rita Gulotta, et al.
Scientific Reports
|
October 25, 2022
KUALA: a machine learning-driven framework for kinase inhibitors repositioning
Giada De Simone, Davide Stefano Sardina, Maria Rita Gulotta, et al.
International Journal of Molecular Sciences
|
June 2, 2021
A Computer-Based Methodology to Design Non-Standard Peptides Potentially Able to Prevent HOX-PBX1-Associated Cancer Diseases
Maria Rita Gulotta, Giada De Simone, Justin John, et al.
Current Pharmaceutical Design
|
February 25, 2016
Drugs Polypharmacology by In Silico Methods: New Opportunities in Drug Discovery
Antonino Lauria, Riccardo Bonsignore, Roberta Bartolotta, et al.
International Journal of Molecular Sciences
|
March 6, 2021
Exploring Molecular Contacts of MUC1 at CIN85 Binding Interface to Address Future Drug Design Efforts
Maria Rita Gulotta, Serena Vittorio, Rosaria Gitto, et al.
Journal of Cellular Physiology
|
March 7, 2017
2-methoxyestradiol impacts on amino acids-mediated metabolic reprogramming in osteosarcoma cells by its interaction with NMDA receptor
Magdalena Gorska-Ponikowska, Ugo Perricone, Alicja Kuban-Jankowska, et al.
Chemical Science
|
October 27, 2023
Resolving a guanine-quadruplex structure in the SARS-CoV-2 genome through circular dichroism and multiscale molecular modeling
Luisa D'Anna, Tom Miclot, Emmanuelle Bignon, et al.
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of 5
Search research articles
Search
Showing results (11-20 of 44) with videos related to
Sort By:
Page
of 5
Biochemical and Biophysical Research Communications
|
January 20, 2016
Evaluating the stability of pharmacophore features using molecular dynamics simulations
Marcus Wieder, Ugo Perricone, Stefan Boresch, et al.
International Journal of Molecular Sciences
|
February 26, 2022
EMBER-Embedding Multiple Molecular Fingerprints for Virtual Screening
Isabella Mendolia, Salvatore Contino, Giada De Simone, et al.
International Journal of Molecular Sciences
|
July 24, 2021
Support Vector Machine as a Supervised Learning for the Prioritization of Novel Potential SARS-CoV-2 Main Protease Inhibitors
Nedra Mekni, Claudia Coronnello, Thierry Langer, et al.
BMC Bioinformatics
|
October 23, 2025
Unveiling molecular moieties through hierarchical Grad-CAM graph explainability
Salvatore Contino, Paolo Sortino, Maria Rita Gulotta, et al.
Scientific Reports
|
October 25, 2022
KUALA: a machine learning-driven framework for kinase inhibitors repositioning
Giada De Simone, Davide Stefano Sardina, Maria Rita Gulotta, et al.
International Journal of Molecular Sciences
|
June 2, 2021
A Computer-Based Methodology to Design Non-Standard Peptides Potentially Able to Prevent HOX-PBX1-Associated Cancer Diseases
Maria Rita Gulotta, Giada De Simone, Justin John, et al.
Current Pharmaceutical Design
|
February 25, 2016
Drugs Polypharmacology by In Silico Methods: New Opportunities in Drug Discovery
Antonino Lauria, Riccardo Bonsignore, Roberta Bartolotta, et al.
International Journal of Molecular Sciences
|
March 6, 2021
Exploring Molecular Contacts of MUC1 at CIN85 Binding Interface to Address Future Drug Design Efforts
Maria Rita Gulotta, Serena Vittorio, Rosaria Gitto, et al.
Journal of Cellular Physiology
|
March 7, 2017
2-methoxyestradiol impacts on amino acids-mediated metabolic reprogramming in osteosarcoma cells by its interaction with NMDA receptor
Magdalena Gorska-Ponikowska, Ugo Perricone, Alicja Kuban-Jankowska, et al.
Chemical Science
|
October 27, 2023
Resolving a guanine-quadruplex structure in the SARS-CoV-2 genome through circular dichroism and multiscale molecular modeling
Luisa D'Anna, Tom Miclot, Emmanuelle Bignon, et al.
Page
of 5