392 results on '"D'Abramo, Marco"'
Search Results
2. Binding of steroid substrates reveals the key to the productive transition of the cytochrome P450 OleP
3. Supramolecular citrate poly allylamine hydrochloride nanoparticles for citrate delivery and calcium oxalate nanocrystal dissolution
4. Conformational and dynamic properties of the KH1 domain of FMRP and its fragile X syndrome linked G266E variant
5. Modeling the temperature dependence of the fluorescence properties of Indole in aqueous solution
6. A study of cyanidin/alginate complexation: Influence of pH in assembly and chiral properties
7. Bioderived, chiral and stable 1-dimensional light-responsive nanostructures: Interconversion between tubules and twisted ribbons
8. Theoretical-computational modelling of the L-alanine CD spectrum in water
9. Electric-driven membrane poration: A rationale for water role in the kinetics of pore formation
10. A Theoretical‐Computational Study of Phosphodiester Bond Cleavage Kinetics as a Function of the Temperature
11. Theoretical Insights into MutY Glycosylase DNA Repair Mechanism.
12. Unveiling the Cleavage Mechanism of an RNA Model Compound on the whole pH Scale: Computations Meet Experiments in the Determination of Reaction Rates.
13. A Spectroscopic and Structural Study on the Solvent-Promoted Stereospecific Self-Assembly of New Porphyrin-Bile Salt Conjugates
14. The self-association equilibria of doxorubicin at high concentration and ionic strength characterized by fluorescence spectroscopy and molecular dynamics simulations
15. A finely balanced order-disorder equilibrium sculpts the folding-binding landscape of an antibiotic sequestering protein.
16. Molecular Modeling of the Deamidation Reaction in Solution: A Theoretical–Computational Study
17. On the activation and deactivation pathways of the Lck kinase domain: a computational study
18. ERAP1 and ERAP2 Haplotypes Influence Suboptimal HLA-B*27:05-Restricted Anti-Viral CD8+ T Cell Responses Cross-Reactive to Self-Epitopes
19. Unveiling the Excited State Dynamics of Indole in Solution
20. DNA cleavage by endonuclease I-DmoI: a QM/MM study and comparison with experimental data provide indications on the environmental effects
21. P1 Push‐Pull Dye as a Case Study in QM/MM Theoretical Characterization for Dye‐sensitized Solar Cell Organic Chromophores**
22. Kinetics and mechanistic study of competitive inhibition of thymidine phosphorylase by 5-fluoruracil derivatives
23. Computational Modeling of the Thermodynamics of the Mesophilic and Thermophilic Mutants of Trp-Cage Miniprotein
24. Role of the hydrophilic spacer of glucosylated amphiphiles included in liposome formulations in the recognition of Concanavalin A
25. Modelling Complex Bimolecular Reactions in a Condensed Phase: The Case of Phosphodiester Hydrolysis
26. Effect of Salts on the Conformational Dynamics of the Cytochrome P450 OleP
27. A Study of Cyanidin/Alginate Complexation: Influence of Ph in Assembly and Chiral Properties
28. Modeling the Temperature Dependence of the Fluorescence Properties of Indole in Aqueous Solution
29. Role of the membrane anchor in the regulation of Lck activity
30. Structure and dynamics of mesophilic variants from the homing endonuclease I-DmoI
31. A Simplified Treatment for Efficiently Modeling the Spectral Signal of Vibronic Transitions: Application to Aqueous Indole
32. Theoretical Evaluation of Sulfur-Based Reactions as a Model for Biological Antioxidant Defense
33. PyMM: An Open-Source Python Program for QM/MM Simulations Based on the Perturbed Matrix Method
34. Modeling Charge Transfer Reactions by Hopping between Electronic Ground State Minima: Application to Hole Transfer between DNA Bases
35. Effects of Environmental and Electric Perturbations on the pKa of Thioredoxin Cysteine 35: A Computational Study
36. Understanding the indirect DNA read-out specificity of I-CreI Meganuclease
37. Atomic-Level View of the Functional Transition in Vertebrate Hemoglobins: The Case of Antarctic Fish Hbs
38. Rationalizing Sequence and Conformational Effects on the Guanine Oxidation in Different DNA Conformations
39. A role of Lck annular lipids in the steady upkeep of active Lck in T cells
40. The Full Model of the pMHC-TCR-CD3 Complex: A Structural and Dynamical Characterization of Bound and Unbound States
41. Theoretical Modeling of Redox Potentials of Biomolecules
42. Complexation and organization of doxorubicin on polystyrene sulfonate chains: impacts on doxorubicin dimerization and quenching
43. Absorption behavior of doxorubicin hydrochloride in visible region in different environments: a combined experimental and computational study
44. Point Mutations at a Key Site Alter the Cytochrome P450 OleP Structural Dynamics
45. PyMM: An Open-Source Python Program for QM/MM Simulations Based on the Perturbed Matrix Method.
46. Photoinduced electron transfer in a dichromophoric peptide: a numerical experiment
47. What can we learn by comparing experimental and theoretical-computational X-ray scattering data?
48. Effects of Environmental and Electric Perturbations on the pKa of Thioredoxin Cysteine 35: A Computational Study.
49. Quaternary Structure Transitions of Human Hemoglobin: An Atomic-Level View of the Functional Intermediate States
50. Modelling the Activation Pathways in Full-Length Src Kinase
Catalog
Books, media, physical & digital resources
Discovery Service for Jio Institute Digital Library
For full access to our library's resources, please sign in.