Found: 42
Select item for more details and to access through your institution.
Potential Energy Surfaces for Noble Gas (Ar, Kr, Xe, Rn)–Propylene Oxide Systems: Analytical Formulation and Binding.
- Published in:
- Symmetry (20738994), 2022, v. 14, n. 2, p. N.PAG, doi. 10.3390/sym14020249
- By:
- Publication type:
- Article
Condensation of β-Diester Titanium Enolates with Carbonyl Substrates: A Combined DFT and Experimental Investigation.
- Published in:
- Chemistry - A European Journal, 2009, v. 15, n. 43, p. 11537, doi. 10.1002/chem.200901595
- By:
- Publication type:
- Article
Anti-Staphylococcal Activity of the Auranofin Analogue Bearing Acetylcysteine in Place of the Thiosugar: An Experimental and Theoretical Investigation.
- Published in:
- Molecules, 2022, v. 27, n. 8, p. N.PAG, doi. 10.3390/molecules27082578
- By:
- Publication type:
- Article
Computational Studies of Au(I) and Au(III) Anticancer MetalLodrugs: A Survey.
- Published in:
- Molecules, 2021, v. 26, n. 24, p. 7600, doi. 10.3390/molecules26247600
- By:
- Publication type:
- Article
Short and Long Time Bloodstains Age Determination by Colorimetric Analysis: A Pilot Study.
- Published in:
- Molecules, 2021, v. 26, n. 20, p. 6272, doi. 10.3390/molecules26206272
- By:
- Publication type:
- Article
Mechanism of Action of Antitumor Au(I) N-Heterocyclic Carbene Complexes: A Computational Insight on the Targeting of TrxR Selenocysteine.
- Published in:
- International Journal of Molecular Sciences, 2024, v. 25, n. 5, p. 2625, doi. 10.3390/ijms25052625
- By:
- Publication type:
- Article
Forensic Proteomics for the Discovery of New post mortem Interval Biomarkers: A Preliminary Study.
- Published in:
- International Journal of Molecular Sciences, 2023, v. 24, n. 19, p. 14627, doi. 10.3390/ijms241914627
- By:
- Publication type:
- Article
Medicinal Hypervalent Tellurium Prodrugs Bearing Different Ligands: A Comparative Study of the Chemical Profiles of AS101 and Its Halido Replaced Analogues.
- Published in:
- International Journal of Molecular Sciences, 2022, v. 23, n. 14, p. 7505, doi. 10.3390/ijms23147505
- By:
- Publication type:
- Article
Reactivity of Gold(I) Monocarbene Complexes with Protein Targets: A Theoretical Study.
- Published in:
- International Journal of Molecular Sciences, 2019, v. 20, n. 4, p. 820, doi. 10.3390/ijms20040820
- By:
- Publication type:
- Article
Seeking for Non-Zinc-Binding MMP-2 Inhibitors: Synthesis, Biological Evaluation and Molecular Modelling Studies.
- Published in:
- International Journal of Molecular Sciences, 2016, v. 17, n. 10, p. 1768, doi. 10.3390/ijms17101768
- By:
- Publication type:
- Article
The FMO2 analysis of the ligand-receptor binding energy: the Biscarbene-Gold(I)/DNA G-Quadruplex case study.
- Published in:
- Journal of Computer-Aided Molecular Design, 2022, v. 36, n. 12, p. 851, doi. 10.1007/s10822-022-00484-z
- By:
- Publication type:
- Article
Hampering the early aggregation of PrP-E200K protein by charge-based inhibitors: a computational study.
- Published in:
- Journal of Computer-Aided Molecular Design, 2021, v. 35, n. 6, p. 751, doi. 10.1007/s10822-021-00393-7
- By:
- Publication type:
- Article
The Role of APOSTART in Switching between Sexuality and Apomixis in Poa pratensis.
- Published in:
- Genes, 2020, v. 11, n. 8, p. 941, doi. 10.3390/genes11080941
- By:
- Publication type:
- Article
The redox-active defensive Selenoprotein T as a novel stress sensor protein playing a key role in the pathophysiology of heart failure.
- Published in:
- Journal of Translational Medicine, 2024, v. 22, n. 1, p. 1, doi. 10.1186/s12967-024-05192-w
- By:
- Publication type:
- Article
Inorganic Drugs as a Tool for Protein Structure Solving and Studies on Conformational Changes.
- Published in:
- Chemistry - A European Journal, 2023, v. 29, n. 16, p. 1, doi. 10.1002/chem.202202937
- By:
- Publication type:
- Article
Hemp Cultivation in Soils Polluted by Cd, Pb and Zn in the Mediterranean Area: Sites Characterization and Phytoremediation in Real Scale Settlement.
- Published in:
- Applied Sciences (2076-3417), 2022, v. 12, n. 7, p. 3548, doi. 10.3390/app12073548
- By:
- Publication type:
- Article
Microplastics in the Center of Mediterranean: Comparison of the Two Calabrian Coasts and Distribution from Coastal Areas to the Open Sea.
- Published in:
- International Journal of Environmental Research & Public Health, 2021, v. 18, n. 20, p. 10712, doi. 10.3390/ijerph182010712
- By:
- Publication type:
- Article
Parallel arrangement of peptides appended to a rigid, bimetallic, constrained ring system.
- Published in:
- Peptide Science, 2022, v. 114, n. 6, p. 1, doi. 10.1002/pep2.24286
- By:
- Publication type:
- Article
Oxidative Imbalance and Kidney Damage in Cafeteria Diet-Induced Rat Model of Metabolic Syndrome: Effect of Bergamot Polyphenolic Fraction.
- Published in:
- Pharmacy, 2019, v. 7, n. 1, p. 66, doi. 10.3390/antiox8030066
- By:
- Publication type:
- Article
Calcium Binding Promotes Prion Protein Fragment 90- 231 Conformational Change toward a Membrane Destabilizing and Cytotoxic Structure.
- Published in:
- PLoS ONE, 2012, v. 7, n. 7, p. 1, doi. 10.1371/journal.pone.0038314
- By:
- Publication type:
- Article
Targeting Aquaporin Function: Potent Inhibition of Aquaglyceroporin-3 by a Gold-Based Compound.
- Published in:
- PLoS ONE, 2012, v. 7, n. 5, p. 1, doi. 10.1371/journal.pone.0037435
- By:
- Publication type:
- Article
Activation of carboplatin by chloride ions: a theoretical investigation.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 129, n. 6, p. 757, doi. 10.1007/s00214-011-0933-9
- By:
- Publication type:
- Article
Diruthenium Paddlewheel Complexes Attacking Proteins: Axial versus Equatorial Coordination.
- Published in:
- Biomolecules (2218-273X), 2024, v. 14, n. 5, p. 530, doi. 10.3390/biom14050530
- By:
- Publication type:
- Article
In Vitro Anti-SARS-CoV-2 Activity of Selected Metal Compounds and Potential Molecular Basis for Their Actions Based on Computational Study.
- Published in:
- Biomolecules (2218-273X), 2021, v. 11, n. 12, p. 1858, doi. 10.3390/biom11121858
- By:
- Publication type:
- Article
Aquaporin Inhibition by Gold(III) Compounds: New Insights.
- Published in:
- ChemMedChem, 2013, v. 8, n. 7, p. 1086, doi. 10.1002/cmdc.201300107
- By:
- Publication type:
- Article
Poly(ADP-Ribose)-Polymerase-Catalyzed Hydrolysis of NAD<sup>+</sup>: QM/MM Simulation of the Enzyme Reaction.
- Published in:
- ChemMedChem, 2006, v. 1, n. 5, p. 533, doi. 10.1002/cmdc.200500061
- By:
- Publication type:
- Article
An insight of early PrP‐E200K aggregation by combined molecular dynamics/fragment molecular orbital approaches.
- Published in:
- Proteins, 2019, v. 87, n. 1, p. 51, doi. 10.1002/prot.25621
- By:
- Publication type:
- Article
Investigation of the molecular similarity in closely related protein systems: The Pr P case study.
- Published in:
- Proteins, 2015, v. 83, n. 10, p. 1751, doi. 10.1002/prot.24836
- By:
- Publication type:
- Article
A Multi-Level Theoretical Study to Disclose the Binding Mechanisms of Gold(III)-Bipyridyl Compounds as Selective Aquaglyceroporin Inhibitors.
- Published in:
- Chemistry - A European Journal, 2017, v. 23, n. 55, p. 13802, doi. 10.1002/chem.201703092
- By:
- Publication type:
- Article
ANTI-FOULING ADDITIVES FOR THE CONSOLIDATION OF ARCHAEOLOGICAL MORTARS IN UNDERWATER ENVIRONMENT: EFFICACY TESTS PERFORMED ON THE APSIDAL FISHPOND OF CASTRUM NOVUM (ROME, ITALY).
- Published in:
- International Journal of Conservation Science, 2020, v. 11, p. 243
- By:
- Publication type:
- Article
The Effects of Ca<sup>2+</sup> Concentration and E200K Mutation on the Aggregation Propensity of PrP<sup>C</sup>: A Computational Study.
- Published in:
- PLoS ONE, 2016, v. 11, n. 12, p. 1, doi. 10.1371/journal.pone.0168039
- By:
- Publication type:
- Article
Activity of matrix metallo proteinases (MMPs) and the tissue inhibitor of MMP (TIMP)-1 in electromagnetic field-exposed THP-1 cells.
- Published in:
- Journal of Cellular Physiology, 2012, v. 227, n. 6, p. 2767, doi. 10.1002/jcp.23024
- By:
- Publication type:
- Article
Antioxidant/Anti-Inflammatory Effects of Caloric Restriction in an Aged and Obese Rat Model: The Role of Adiponectin.
- Published in:
- Biomedicines, 2020, v. 8, n. 12, p. 532, doi. 10.3390/biomedicines8120532
- By:
- Publication type:
- Article
The 7Ds for Sustainability – Defence in Depth.
- Published in:
- European View, 2024, v. 23, n. 1, p. 123, doi. 10.1177/17816858241249262
- By:
- Publication type:
- Article
Molecular dynamics simulation of the Pb(II) coordination in biological media via cationic dummy atom models.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2021, v. 140, n. 2, p. 1, doi. 10.1007/s00214-021-02718-z
- By:
- Publication type:
- Article
Reactivity of arsenoplatin complex versus water and thiocyanate: a DFT benchmark study.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 12, p. 1, doi. 10.1007/s00214-020-02694-w
- By:
- Publication type:
- Article
Caloric Restriction Mitigates Kidney Fibrosis in an Aged and Obese Rat Model.
- Published in:
- Antioxidants, 2023, v. 12, n. 9, p. 1778, doi. 10.3390/antiox12091778
- By:
- Publication type:
- Article
Oxidative Imbalance and Kidney Damage: New Study Perspectives from Animal Models to Hospitalized Patients.
- Published in:
- Antioxidants, 2019, v. 8, n. 12, p. 594, doi. 10.3390/antiox8120594
- By:
- Publication type:
- Article
Oxidative Imbalance and Kidney Damage in Cafeteria Diet-Induced Rat Model of Metabolic Syndrome: Effect of Bergamot Polyphenolic Fraction.
- Published in:
- Antioxidants, 2019, v. 8, n. 3, p. 66, doi. 10.3390/antiox8030066
- By:
- Publication type:
- Article
Auranofin Targeting the NDM-1 Beta-Lactamase: Computational Insights into the Electronic Configuration and Quasi-Tetrahedral Coordination of Gold Ions.
- Published in:
- Pharmaceutics, 2023, v. 15, n. 3, p. 985, doi. 10.3390/pharmaceutics15030985
- By:
- Publication type:
- Article
A computational insight on the aromatic amino acids conjugation with [Cp*Rh(H<sub>2</sub>O)<sub>3</sub>]<sup>2+</sup> by using the meta-dynamics/FMO3 approach.
- Published in:
- Journal of Molecular Modeling, 2024, v. 30, n. 1, p. 1, doi. 10.1007/s00894-023-05794-z
- By:
- Publication type:
- Article
Homodimeric complexes of the 90–231 human prion: a multilayered computational study based on FMO/GRID-DRY approach.
- Published in:
- Journal of Molecular Modeling, 2022, v. 28, n. 8, p. 1, doi. 10.1007/s00894-022-05244-2
- By:
- Publication type:
- Article