List of works - Giampaolo Barone

(Dipyrido[3,2-a:2',3'-c]phenazine)(glycinato)copper(II) perchlorate: a novel DNA-intercalator with anti-proliferative activity against thyroid cancer cell lines.

scientific article

2-Methoxyestradiol Affects Mitochondrial Biogenesis Pathway and Succinate Dehydrogenase Complex Flavoprotein Subunit A in Osteosarcoma Cancer Cells

scientific article published in January 2018

2-methoxyestradiol impacts on amino acids-mediated metabolic reprogramming in osteosarcoma cells by its interaction with NMDA receptor.

scientific article published on 6 March 2017

A Novel Peptide with Antifungal Activity from Red Swamp Crayfish Procambarus clarkii

scientific article published in 2022

A Synthetic Derivative of Antimicrobial Peptide Holothuroidin 2 from Mediterranean Sea Cucumber () in the Control of

scientific article published on 08 March 2019

A peptide from human β thymosin as a platform for the development of new anti-biofilm agents for Staphylococcus spp. and Pseudomonas aeruginosa

scientific article published on 23 June 2016

A synchrotron radiation X-ray scattering study of aqueous solutions of native DNA

A theoretical and experimental investigation of the spectroscopic properties of a DNA-intercalator salphen-type Zn(II) complex

scientific article published on 14 May 2014

Adsorbed CO on group 10 metal fragments: a DFT study

scientific article published on 01 May 2009

Ag2 and Ag3 clusters: synthesis, characterization, and interaction with DNA.

scientific article published on 12 May 2015

Analytic high-order Douglas-Kroll-Hess electric field gradients

Another step toward DNA selective targeting: Ni(II) and Cu(II) complexes of a Schiff base ligand able to bind gene promoter G-quadruplexes

scientific article

B-DNA Structure and Stability as Function of Nucleic Acid Composition: Dispersion-Corrected DFT Study of Dinucleoside Monophosphate Single and Double Strands

scientific article published on 16 August 2013

Carbon-Phosphorus Coupling from C^N Cyclometalated AuIII Complexes

scientific article published on 06 March 2020

Circular Dichroism of DNA G-Quadruplexes: Combining Modeling and Spectroscopy To Unravel Complex Structures

scientific article published on 17 March 2016

Confined But-2-ene Catalytic Isomerization Inside H-ZSM-5 Models: A DFT Study

scientific article published on 01 May 2009

Cyclometalated Au III Complexes for Cysteine Arylation in Zinc Finger Protein Domains: towards Controlled Reductive Elimination

scientific article published on 09 May 2019

DFT calculations of the electric field gradient at the tin nucleus as a support of structural interpretation by 119Sn Mössbauer spectroscopy

scientific article published on 01 October 2005

DHFR Inhibitors: Reading the Past for Discovering Novel Anticancer Agents

scientific article published on 22 March 2019

DNA binding and antiproliferative activity toward human carcinoma cells of copper(ii) and zinc(ii) complexes of a 2,5-diphenyl[1,3,4]oxadiazole derivative ⬇️

scientific article published on February 15, 2012

DNA interaction of CuII, NiII and ZnII functionalized salphen complexes: studies by linear dichroism, gel electrophoresis and PCR.

scientific article published in August 2013

Deposition of tin sulfide thin films from tin(iv) thiolate precursors

article published in 2001

Does ligand symmetry play a role in the stabilization of DNA G-quadruplex host-guest complexes?

scientific article published on January 2014

Enhancement of premature stop codon readthrough in the CFTR gene by Ataluren (PTC124) derivatives

scientific article

Experimental and DFT Studies on Competitive Heterocyclic Rearrangements. 3.†A Cascade Isoxazole−1,2,4-Oxadiazole−Oxazole Rearrangement‡

scientific article published on 01 January 2009

Experimental and DFT Studies on Competitive Heterocyclic Rearrangements. Part 2:1A One-Atom Side-Chain versus the Classic Three-Atom Side-Chain (Boulton−Katritzky) Ring Rearrangement of 3-Acylamino-1,2,4-oxadiazoles‡

scientific article published on 07 September 2007

Fluorescence emission and enhanced photochemical stability of Zn(II)-5-triethyl ammonium methyl salicylidene ortho-phenylendiiminate interacting with native DNA

scientific article published on 31 March 2010

G-quadruplex vs. duplex-DNA binding of nickel(II) and zinc(II) Schiff base complexes.

scientific article

Hsp60, a novel target for antitumor therapy: structure-function features and prospective drugs design

scientific article published on January 2013

IDEA: interface dynamics and energetics algorithm

scientific article published in November 2007

Identification of New Antimicrobial Peptides from Mediterranean Medical Plant Charybdis pancration (Steinh.) Speta

scientific article published on 28 October 2020

Interaction of doxorubicin with polynucleotides. A spectroscopic study.

scientific article published on 29 March 2014

Intercalation of daunomycin into stacked DNA base pairs. DFT study of an anticancer drug

scientific article published on 01 August 2008

Kinetic evidence for interaction of TMPyP4 with two different G-quadruplex conformations of human telomeric DNA.

scientific article

Metal Ions and Metal Complexes in Alzheimer's Disease.

scientific article published on 20 May 2016

Metal complex-DNA binding: Insights from molecular dynamics and DFT/MM calculations

scientific article published on 29 March 2013

Modification of DNA structure by reactive nitrogen species as a result of 2-methoxyestradiol-induced neuronal nitric oxide synthase uncoupling in metastatic osteosarcoma cells

scientific article published on 28 March 2020

Molecular Basis of SARS-CoV-2 Infection and Rational Design of Potential Antiviral Agents: Modeling and Simulation Approaches

scientific article published on 29 October 2020

Molecular recognition of naphthalene diimide ligands by telomeric quadruplex-DNA: the importance of the protonation state and mediated hydrogen bonds

scientific article published on 01 January 2016

Multivariate analysis in the identification of biological targets for designed molecular structures: the BIOTA protocol

scientific article published on 28 January 2014

New benzothieno[3,2-d]-1,2,3-triazines with antiproliferative activity: synthesis, spectroscopic studies, and biological activity.

scientific article published on 17 June 2014

Nickel(II), copper(II) and zinc(II) metallo-intercalators: structural details of the DNA-binding by a combined experimental and computational investigation

scientific article published on 01 April 2014

Nuclear Quadrupole Moment of119Sn

On the structure of 3-acetylamino-5-methyl-1,2,4-oxadiazole and on the fully degenerate rearrangements (FDR) of its anion: a stimulating comparison between the results of ‘in-silicon chemistry’ and ‘laboratory chemistry’

Paracentrin 1, a synthetic antimicrobial peptide from the sea-urchin Paracentrotus lividus, interferes with staphylococcal and Pseudomonas aeruginosa biofilm formation

scientific article published on 31 October 2014

Perturbation of Developmental Regulatory Gene Expression by a G-Quadruplex DNA Inducer in the Sea Urchin Embryo

scientific article published on 17 July 2018

Photochemical functionalization of allyl benzoates by C–H insertion

Photochemistry of 1,2,4-Oxadiazoles. A DFT Study on Photoinduced Competitive Rearrangements of 3-Amino- and 3-N-Methylamino-5-perfluoroalkyl-1,2,4-oxadiazoles

scientific article published on 01 March 2006

Pyrrolomycins as antimicrobial agents. Microwave-assisted organic synthesis and insights into their antimicrobial mechanism of action

scientific article published on 16 January 2019

Quaternary structures of GroEL and naïve-Hsp60 chaperonins in solution: a combined SAXS-MD study

scholarly article in RSC Advances, vol. 5 no. 62, 2015

Role of Seroalbumin in the Cytotoxicity of cis-Dichloro Pt(II) Complexes with (N^N)-Donor Ligands Bearing Functionalized Tails.

scientific article published on 3 May 2018

SCSA code: applications on the cyclopeptide renieramide

scientific article published in May 2004

Selective targeting of PARP-1 zinc finger recognition domains with Au(iii) organometallics

scientific article published on 2 January 2018

Spectroscopic study of the interaction of Ni(II)-5-triethyl ammonium methyl salicylidene ortho-phenylendiiminate with native DNA

scientific article published on 22 January 2009

Structure validation of natural products by quantum-mechanical GIAO calculations of 13C NMR chemical shifts

scientific article published on 01 July 2002

Structure-directing and high-efficiency photocatalytic hydrogen production by Ag clusters

scientific article published on 15 January 2014

Synthesis and chemical characterization of CuII, NiII and ZnII complexes of 3,5-bis(2′-pyridyl)-1,2,4-oxadiazole and 3-(2′-pyridyl)5-(phenyl)-1,2,4-oxadiazole ligands

Synthesis, characterization, and cellular investigations of porphyrin– and chlorin–indomethacin conjugates for photodynamic therapy of cancer

Synthesis, characterization, cellular uptake and interaction with native DNA of a bis(pyridyl)-1,2,4-oxadiazole copper(II) complex

scientific article published on 27 August 2010

Targeting G-quadruplexes with Organic Dyes: Chelerythrine-DNA Binding Elucidated by Combining Molecular Modeling and Optical Spectroscopy

scientific article published on 10 October 2019

The Influence of the Amide Linkage in the Fe(III) -Binding Properties of Catechol-Modified Rosamine Derivatives

scientific article published on 07 September 2015

The Right Answer for the Right Electrostatics: Force Field Methods Are Able to Describe Relative Energies of DNA Guanine Quadruplexes

scientific article published on 01 August 2014

The inhibition of glycerol permeation through aquaglyceroporin-3 induced by mercury(II): A molecular dynamics study

scientific article

The interaction of Schiff Base complexes of nickel(II) and zinc(II) with duplex and G-quadruplex DNA.

scientific article published on 3 November 2017

The interaction of native DNA with Zn(II) and Cu(II) complexes of 5-triethyl ammonium methyl salicylidene orto-phenylendiimine

scientific article published on 14 February 2007

The interaction of native DNA with iron(III)- N ,N'-ethylene-bis(salicylideneiminato)-chloride

scientific article published on 01 April 2004

The mechanism of aquaporin inhibition by gold compounds elucidated by biophysical and computational methods

scientific article

The prediction of the nuclear quadrupole splitting of 119Sn Mössbauer spectroscopy data by scalar relativistic DFT calculations

scientific article

Thermodynamics of the Interaction between the Spike Protein of Severe Acute Respiratory Syndrome Coronavirus-2 and the Receptor of Human Angiotensin-Converting Enzyme 2. Effects of Possible Ligands

scientific article published on 21 October 2020

Toward a rationale for the PTC124 (Ataluren) promoted readthrough of premature stop codons: a computational approach and GFP-reporter cell-based assay

scientific article

Zinc complexes as fluorescent chemosensors for nucleic acids: new perspectives for a "boring" element

scientific article

List of works by Giampaolo Barone

(Dipyrido[3,2-a:2',3'-c]phenazine)(glycinato)copper(II) perchlorate: a novel DNA-intercalator with anti-proliferative activity against thyroid cancer cell lines.

2-Methoxyestradiol Affects Mitochondrial Biogenesis Pathway and Succinate Dehydrogenase Complex Flavoprotein Subunit A in Osteosarcoma Cancer Cells

2-methoxyestradiol impacts on amino acids-mediated metabolic reprogramming in osteosarcoma cells by its interaction with NMDA receptor.

A Novel Peptide with Antifungal Activity from Red Swamp Crayfish Procambarus clarkii

A Synthetic Derivative of Antimicrobial Peptide Holothuroidin 2 from Mediterranean Sea Cucumber () in the Control of

A peptide from human β thymosin as a platform for the development of new anti-biofilm agents for Staphylococcus spp. and Pseudomonas aeruginosa

A synchrotron radiation X-ray scattering study of aqueous solutions of native DNA

A theoretical and experimental investigation of the spectroscopic properties of a DNA-intercalator salphen-type Zn(II) complex

Adsorbed CO on group 10 metal fragments: a DFT study

Ag2 and Ag3 clusters: synthesis, characterization, and interaction with DNA.

Analytic high-order Douglas-Kroll-Hess electric field gradients

Another step toward DNA selective targeting: Ni(II) and Cu(II) complexes of a Schiff base ligand able to bind gene promoter G-quadruplexes

B-DNA Structure and Stability as Function of Nucleic Acid Composition: Dispersion-Corrected DFT Study of Dinucleoside Monophosphate Single and Double Strands

Carbon-Phosphorus Coupling from C^N Cyclometalated AuIII Complexes

Circular Dichroism of DNA G-Quadruplexes: Combining Modeling and Spectroscopy To Unravel Complex Structures

Confined But-2-ene Catalytic Isomerization Inside H-ZSM-5 Models: A DFT Study

Cyclometalated Au III Complexes for Cysteine Arylation in Zinc Finger Protein Domains: towards Controlled Reductive Elimination

DFT calculations of the electric field gradient at the tin nucleus as a support of structural interpretation by 119Sn Mössbauer spectroscopy

DHFR Inhibitors: Reading the Past for Discovering Novel Anticancer Agents

DNA binding and antiproliferative activity toward human carcinoma cells of copper(ii) and zinc(ii) complexes of a 2,5-diphenyl[1,3,4]oxadiazole derivative ⬇️

DNA interaction of CuII, NiII and ZnII functionalized salphen complexes: studies by linear dichroism, gel electrophoresis and PCR.

Deposition of tin sulfide thin films from tin(iv) thiolate precursors

Does ligand symmetry play a role in the stabilization of DNA G-quadruplex host-guest complexes?

Enhancement of premature stop codon readthrough in the CFTR gene by Ataluren (PTC124) derivatives

Experimental and DFT Studies on Competitive Heterocyclic Rearrangements. 3.†A Cascade Isoxazole−1,2,4-Oxadiazole−Oxazole Rearrangement‡

Experimental and DFT Studies on Competitive Heterocyclic Rearrangements. Part 2:1A One-Atom Side-Chain versus the Classic Three-Atom Side-Chain (Boulton−Katritzky) Ring Rearrangement of 3-Acylamino-1,2,4-oxadiazoles‡

Fluorescence emission and enhanced photochemical stability of Zn(II)-5-triethyl ammonium methyl salicylidene ortho-phenylendiiminate interacting with native DNA

G-quadruplex vs. duplex-DNA binding of nickel(II) and zinc(II) Schiff base complexes.

Hsp60, a novel target for antitumor therapy: structure-function features and prospective drugs design

IDEA: interface dynamics and energetics algorithm

Identification of New Antimicrobial Peptides from Mediterranean Medical Plant Charybdis pancration (Steinh.) Speta

Interaction of doxorubicin with polynucleotides. A spectroscopic study.

Intercalation of daunomycin into stacked DNA base pairs. DFT study of an anticancer drug

Kinetic evidence for interaction of TMPyP4 with two different G-quadruplex conformations of human telomeric DNA.

Metal Ions and Metal Complexes in Alzheimer's Disease.

Metal complex-DNA binding: Insights from molecular dynamics and DFT/MM calculations

Modification of DNA structure by reactive nitrogen species as a result of 2-methoxyestradiol-induced neuronal nitric oxide synthase uncoupling in metastatic osteosarcoma cells

Molecular Basis of SARS-CoV-2 Infection and Rational Design of Potential Antiviral Agents: Modeling and Simulation Approaches

Molecular recognition of naphthalene diimide ligands by telomeric quadruplex-DNA: the importance of the protonation state and mediated hydrogen bonds

Multivariate analysis in the identification of biological targets for designed molecular structures: the BIOTA protocol

New benzothieno[3,2-d]-1,2,3-triazines with antiproliferative activity: synthesis, spectroscopic studies, and biological activity.

Nickel(II), copper(II) and zinc(II) metallo-intercalators: structural details of the DNA-binding by a combined experimental and computational investigation

Nuclear Quadrupole Moment of119Sn

On the structure of 3-acetylamino-5-methyl-1,2,4-oxadiazole and on the fully degenerate rearrangements (FDR) of its anion: a stimulating comparison between the results of ‘in-silicon chemistry’ and ‘laboratory chemistry’

Paracentrin 1, a synthetic antimicrobial peptide from the sea-urchin Paracentrotus lividus, interferes with staphylococcal and Pseudomonas aeruginosa biofilm formation

Perturbation of Developmental Regulatory Gene Expression by a G-Quadruplex DNA Inducer in the Sea Urchin Embryo

Photochemical functionalization of allyl benzoates by C–H insertion

Photochemistry of 1,2,4-Oxadiazoles. A DFT Study on Photoinduced Competitive Rearrangements of 3-Amino- and 3-N-Methylamino-5-perfluoroalkyl-1,2,4-oxadiazoles

Pyrrolomycins as antimicrobial agents. Microwave-assisted organic synthesis and insights into their antimicrobial mechanism of action

Quaternary structures of GroEL and naïve-Hsp60 chaperonins in solution: a combined SAXS-MD study

Role of Seroalbumin in the Cytotoxicity of cis-Dichloro Pt(II) Complexes with (N^N)-Donor Ligands Bearing Functionalized Tails.

SCSA code: applications on the cyclopeptide renieramide

Selective targeting of PARP-1 zinc finger recognition domains with Au(iii) organometallics

Spectroscopic study of the interaction of Ni(II)-5-triethyl ammonium methyl salicylidene ortho-phenylendiiminate with native DNA

Structure validation of natural products by quantum-mechanical GIAO calculations of 13C NMR chemical shifts

Structure-directing and high-efficiency photocatalytic hydrogen production by Ag clusters

Synthesis and chemical characterization of CuII, NiII and ZnII complexes of 3,5-bis(2′-pyridyl)-1,2,4-oxadiazole and 3-(2′-pyridyl)5-(phenyl)-1,2,4-oxadiazole ligands

Synthesis, characterization, and cellular investigations of porphyrin– and chlorin–indomethacin conjugates for photodynamic therapy of cancer

Synthesis, characterization, cellular uptake and interaction with native DNA of a bis(pyridyl)-1,2,4-oxadiazole copper(II) complex

Targeting G-quadruplexes with Organic Dyes: Chelerythrine-DNA Binding Elucidated by Combining Molecular Modeling and Optical Spectroscopy

The Influence of the Amide Linkage in the Fe(III) -Binding Properties of Catechol-Modified Rosamine Derivatives

The Right Answer for the Right Electrostatics: Force Field Methods Are Able to Describe Relative Energies of DNA Guanine Quadruplexes

The inhibition of glycerol permeation through aquaglyceroporin-3 induced by mercury(II): A molecular dynamics study

The interaction of Schiff Base complexes of nickel(II) and zinc(II) with duplex and G-quadruplex DNA.

The interaction of native DNA with Zn(II) and Cu(II) complexes of 5-triethyl ammonium methyl salicylidene orto-phenylendiimine

The interaction of native DNA with iron(III)- N ,N'-ethylene-bis(salicylideneiminato)-chloride

The mechanism of aquaporin inhibition by gold compounds elucidated by biophysical and computational methods

The prediction of the nuclear quadrupole splitting of 119Sn Mössbauer spectroscopy data by scalar relativistic DFT calculations

Thermodynamics of the Interaction between the Spike Protein of Severe Acute Respiratory Syndrome Coronavirus-2 and the Receptor of Human Angiotensin-Converting Enzyme 2. Effects of Possible Ligands

Toward a rationale for the PTC124 (Ataluren) promoted readthrough of premature stop codons: a computational approach and GFP-reporter cell-based assay

Zinc complexes as fluorescent chemosensors for nucleic acids: new perspectives for a "boring" element