PARISE, ANGELA
PARISE, ANGELA
Istituto Officina dei Materiali - IOM -
Identification of a new small Rho GTPase inhibitor effective in glioblastoma human cells
2025 Parise, A.; Manini, I.; Pobega, E.; Covaceuszach, S.; Secco, L.; Simonelli, F.; Mastantuono, S.; Di Loreto, C.; Pizzignach, A.; Skrap, M.; Vindigni, M.; Sgarra, R.; Manfioletti, G.; Cesselli, D.; Magistrato, A.
Assessing the mechanism of fast-cycling cancer-associated mutations of Rac1 small Rho GTPase
2024 Parise, Angela; Magistrato, Alessandra
Assessing the Mechanism of Rac1b: An All-Atom Simulation Study of the Alternative Spliced Variant of Rac1 Small Rho GTPase
2024 Cresca, Sofia; Parise, Angela; Magistrato, Alessandra
Molecular dynamics simulations for the structure-based drug design: targeting small-GTPases proteins
2024 Parise, Angela; Cresca, Sofia; Magistrato, Alessandra
On the Mechanism of the Lysosomal Enzyme Iduronate‐2‐sulfatase. A Multiscale Approach
2024 Prejanò, Mario; Romeo, Isabella; Talerico, Cristina; Parise, Angela; Russo, Nino; Marino, Tiziana
The Effect of Chalcogen-Chalcogen Bond Formation in the New Delhi Metallo-β-Lactamase 1 Enzyme to Counteract Antibiotic Resistance
2024 Ciardullo, G.; Prejano, M.; Parise, A.; Russo, N.; Marino, T.
Viral RNA Replication Suppression of SARS-CoV-2: Atomistic Insights into Inhibition Mechanisms of RdRp Machinery by ddhCTP
2024 Ciardullo, Giada; Parise, Angela; Prejanò, Mario; Marino, Tiziana
Current status of deMon2k for the investigation of the early stages of matter irradiation by time-dependent DFT approaches
2023 Omar, Karwan A.; Korsaye, Feven A.; Tandiana, Rika; Tolu, Damien; Deviers, Jean; Wu, Xiaojing; Parise, Angela; Alvarez-Ibarra, Aurelio; Moncada, Felix; Pedroza-Montero, Jesus Nain; Mejía-Rodriguez, Daniel; Van-Oanh, Nguyen-Thi; Cailliez, Fabien; Clavaguéra, Carine; Hasnaoui, Karim; de la Lande, Aurélien
On the Recognition of Natural Substrate CTP and Endogenous Inhibitor ddhCTP of SARS-CoV-2 RNA-Dependent RNA Polymerase: A Molecular Dynamics Study
2022 Parise, Angela; Ciardullo, Giada; Prejanò, Mario; Lande, Aurélien de la; Marino, Tiziana
Quantum mechanical predictions of the antioxidant capability of moracin C isomers
2021 Parise, Angela; De, Simone; Marino, Tiziana; Toscano, ; Russo,
The platination mechanism of RNase A by arsenoplatin: Insight from the theoretical study
2021 Parise, A.; Russo, N.; Marino, T.
The se–s bond formation in the covalent inhibition mechanism of sars-cov-2 main protease by ebselen-like inhibitors: A computational study
2021 Parise, A.; Romeo, I.; Russo, N.; Marino, T.
Attosecond dynamics simulations of glycine irradiated by α-particle: Comment on “A never-ending story in the sky: The secrets of chemical evolution” by C. Puzzarini and V. Barone
2020 Parise, A.; de la Lande, A.; Marino, T.; Russo, N.
The antioxidant capability of higenamine: Insights from theory
2020 Romeo, I.; Parise, A.; Galano, A.; Russo, N.; Alvarez-Idaboy, J. R.; Marino, T.
The generation of the oxidant agent of a mononuclear nonheme Fe(II) biomimetic complex by oxidative decarboxylation. A DFT investigation
2020 Parise, A.; Muraca, M. C.; Russo, N.; Toscano, M.; Marino, T.
The physical stage of radiolysis of solvated DNA by high-energy-transfer particles: Insights from new first principles simulations
2020 Alvarez-Ibarra, A.; Parise, A.; Hasnaoui, K.; De La Lande, A.