20 results on '"Nardi, Alessandro Nicola"'
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2. A study of cyanidin/alginate complexation: Influence of pH in assembly and chiral properties
3. Theoretical Insights into MutY Glycosylase DNA Repair Mechanism.
4. A Theoretical‐Computational Study of Phosphodiester Bond Cleavage Kinetics as a Function of the Temperature
5. Unveiling the Cleavage Mechanism of an RNA Model Compound on the whole pH Scale: Computations Meet Experiments in the Determination of Reaction Rates.
6. A finely balanced order-disorder equilibrium sculpts the folding-binding landscape of an antibiotic sequestering protein.
7. Molecular Modeling of the Deamidation Reaction in Solution: A Theoretical–Computational Study
8. Modelling Complex Bimolecular Reactions in a Condensed Phase: The Case of Phosphodiester Hydrolysis
9. Effect of Salts on the Conformational Dynamics of the Cytochrome P450 OleP
10. PyMM: An Open-Source Python Program for QM/MM Simulations Based on the Perturbed Matrix Method
11. Modeling Charge Transfer Reactions by Hopping between Electronic Ground State Minima: Application to Hole Transfer between DNA Bases
12. Rationalizing Sequence and Conformational Effects on the Guanine Oxidation in Different DNA Conformations
13. Theoretical Modeling of Redox Potentials of Biomolecules
14. Complexation and organization of doxorubicin on polystyrene sulfonate chains: impacts on doxorubicin dimerization and quenching
15. Absorption behavior of doxorubicin hydrochloride in visible region in different environments: a combined experimental and computational study
16. Point Mutations at a Key Site Alter the Cytochrome P450 OleP Structural Dynamics
17. PyMM: An Open-Source Python Program for QM/MM Simulations Based on the Perturbed Matrix Method.
18. Theoretical Characterization of the Reduction Potentials of Nucleic Acids in Solution
19. Point Mutations at a Key Site Alter the Cytochrome P450 OleP Structural Dynamics.
20. Theoretical Characterization of the Reduction Potentials of Nucleic Acids in Solution.
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