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Journal of Chemical Information and Modeling
|
May 19, 2026
PyRMD Studio: A Unified Suite for Next-Generation, AI-Powered Virtual Screening
Benito Natale, Muhammad Waqas, Michele Roggia, et al.
Journal of Chemical Information and Modeling
|
August 8, 2023
Streamlining Large Chemical Library Docking with Artificial Intelligence: the PyRMD2Dock Approach
Michele Roggia, Benito Natale, Giorgio Amendola, et al.
Protein Science : a Publication of the Protein Society
|
March 8, 2026
StabLyzeGraph: High-throughput screening of combinatorial mutations using graph neural networks
Muhammad Waqas, Benito Natale, Michele Roggia, et al.
International Journal of Molecular Sciences
|
April 14, 2026
Synthesis of New Asymmetrical Chalcones and Evaluation of Their Use in Combination with Curcumin Against Rhodesain of <i>T. brucei rhodesiense</i>
Carla Di Chio, Josè Starvaggi, Benito Natale, et al.
Pharmaceuticals (Basel, Switzerland)
|
June 27, 2025
Synthesis and Combination Studies of Novel Dipeptide Nitriles with Curcumin for a Potent Synergistic Action Against Rhodesain, Cysteine Protease of <i>Trypanosoma brucei rhodesiense</i>
Carla Di Chio, Josè Starvaggi, Santo Previti, et al.
Journal of Chemical Information and Modeling
|
September 14, 2024
Discovering Dually Active Anti-cancer Compounds with a Hybrid AI-structure-based Approach
Michele Roggia, Benito Natale, Giorgio Amendola, et al.
European Journal of Medicinal Chemistry
|
February 19, 2025
Identification of constrained peptidomimetics carrying a Michael acceptor warhead as antitrypanosomal agents
Santo Previti, Elsa Calcaterra, Carla Di Chio, et al.
International Journal of Molecular Sciences
|
April 27, 2024
Development of Novel Peptidyl Nitriles Targeting Rhodesain and Falcipain-2 for the Treatment of Sleeping Sickness and Malaria
Carla Di Chio, Josè Starvaggi, Noemi Totaro, et al.
ACS Medicinal Chemistry Letters
|
May 15, 2024
Identification of Dual Inhibitors Targeting Main Protease (M<sup>pro</sup>) and Cathepsin L as Potential Anti-SARS-CoV-2 Agents
Santo Previti, Roberta Ettari, Elsa Calcaterra, et al.
ACS Medicinal Chemistry Letters
|
November 20, 2024
Pursuing Polypharmacology: Benzothiopyranoindoles as G-Quadruplex Stabilizers and Topoisomerase I Inhibitors for Effective Anticancer Strategies
Silvia Salerno, Elisabetta Barresi, Michele Roggia, et al.
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Search research articles
Search
Showing results (1-10 of 15) with videos related to
Sort By:
Page
of 2
Journal of Chemical Information and Modeling
|
May 19, 2026
PyRMD Studio: A Unified Suite for Next-Generation, AI-Powered Virtual Screening
Benito Natale, Muhammad Waqas, Michele Roggia, et al.
Journal of Chemical Information and Modeling
|
August 8, 2023
Streamlining Large Chemical Library Docking with Artificial Intelligence: the PyRMD2Dock Approach
Michele Roggia, Benito Natale, Giorgio Amendola, et al.
Protein Science : a Publication of the Protein Society
|
March 8, 2026
StabLyzeGraph: High-throughput screening of combinatorial mutations using graph neural networks
Muhammad Waqas, Benito Natale, Michele Roggia, et al.
International Journal of Molecular Sciences
|
April 14, 2026
Synthesis of New Asymmetrical Chalcones and Evaluation of Their Use in Combination with Curcumin Against Rhodesain of <i>T. brucei rhodesiense</i>
Carla Di Chio, Josè Starvaggi, Benito Natale, et al.
Pharmaceuticals (Basel, Switzerland)
|
June 27, 2025
Synthesis and Combination Studies of Novel Dipeptide Nitriles with Curcumin for a Potent Synergistic Action Against Rhodesain, Cysteine Protease of <i>Trypanosoma brucei rhodesiense</i>
Carla Di Chio, Josè Starvaggi, Santo Previti, et al.
Journal of Chemical Information and Modeling
|
September 14, 2024
Discovering Dually Active Anti-cancer Compounds with a Hybrid AI-structure-based Approach
Michele Roggia, Benito Natale, Giorgio Amendola, et al.
European Journal of Medicinal Chemistry
|
February 19, 2025
Identification of constrained peptidomimetics carrying a Michael acceptor warhead as antitrypanosomal agents
Santo Previti, Elsa Calcaterra, Carla Di Chio, et al.
International Journal of Molecular Sciences
|
April 27, 2024
Development of Novel Peptidyl Nitriles Targeting Rhodesain and Falcipain-2 for the Treatment of Sleeping Sickness and Malaria
Carla Di Chio, Josè Starvaggi, Noemi Totaro, et al.
ACS Medicinal Chemistry Letters
|
May 15, 2024
Identification of Dual Inhibitors Targeting Main Protease (M<sup>pro</sup>) and Cathepsin L as Potential Anti-SARS-CoV-2 Agents
Santo Previti, Roberta Ettari, Elsa Calcaterra, et al.
ACS Medicinal Chemistry Letters
|
November 20, 2024
Pursuing Polypharmacology: Benzothiopyranoindoles as G-Quadruplex Stabilizers and Topoisomerase I Inhibitors for Effective Anticancer Strategies
Silvia Salerno, Elisabetta Barresi, Michele Roggia, et al.
Page
of 2