Laura Orian (L Orian)

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 37

Top Topics

Structural Basis

Molecular Docking

Reactive Oxygen Species

Top Venues

Inorganic chemistry

Antioxidants (Basel, Switzerland)

Molecules (Basel, Switzerland)

International journal of molecular sciences

This page only lists publications with an associated author ORCID identifier.

Publications

Davide Zeppilli, Anna Aldinio-Colbachini, Giovanni Ribaudo, Cristina Tubaro, Marco Dalla Tiezza, Marco Bortoli, Giuseppe Zagotto, Laura Orian
Antioxidant Chimeric Molecules: Are Chemical Motifs Additive? The Case of a Selenium-Based Ligand. International journal of molecular sciences 24 (14) (2023)
Folorunsho Bright Omage, Andrea Madabeni, Amanda Resende Tucci, Pablo Andrei Nogara, Marco Bortoli, Alice Dos Santos Rosa, Vivian Neuza Dos Santos Ferreira, João Batista Teixeira Rocha, Milene Dias Miranda, Laura Orian
Diphenyl Diselenide and SARS-CoV-2: in silico Exploration of the Mechanisms of Inhibition of Main Protease (M pro ) and Papain-like Protease (PL pro ). Journal of chemical information and modeling (2023)
Davide Zeppilli, Giovanni Ribaudo, Nicola Pompermaier, Andrea Madabeni, Marco Bortoli, Laura Orian
Radical Scavenging Potential of Ginkgolides and Bilobalide: Insight from Molecular Modeling. Antioxidants (Basel, Switzerland) 12 (2) (2023)
Davide Zeppilli, Andrea Madabeni, Luca Sancineto, Luana Bagnoli, Claudio Santi, Laura Orian
Role of Group 12 Metals in the Reduction of H 2 O 2 by Santi's Reagent: A Computational Mechanistic Investigation. Inorganic chemistry (2023)
Davide Zeppilli, Giovanni Ribaudo, Nicola Pompermaier, Andrea Madabeni, Marco Bortoli, Laura Orian
Radical Scavenging Potential of Ginkgolides and Bilobalide: Insight from Molecular Modeling. Antioxidants (Basel, Switzerland) 12 (2) (2023)
Marianna Tosato, Sara Franchi, Marco Dalla Tiezza, Laura Orian, Thomas Gyr, André Alker, Giordano Zanoni, Paolo Pastore, Alberto Andrighetto, Ulli Köster, Mikael Jensen, Helmut Mäcke, Mattia Asti, Valerio Di Marco
Tuning the Framework of Thioether-Functionalized Polyazamacrocycles: Searching for a Chelator for Theranostic Silver Radioisotopes. Inorganic chemistry (2023)
Andrea Madabeni, Laura Orian
The Key Role of Chalcogenurane Intermediates in the Reduction Mechanism of Sulfoxides and Selenoxides by Thiols Explored In Silico. International journal of molecular sciences 24 (9) (2023)
Davide Zeppilli, Giovanni Ribaudo, Nicola Pompermaier, Andrea Madabeni, Marco Bortoli, Laura Orian
Radical Scavenging Potential of Ginkgolides and Bilobalide: Insight from Molecular Modeling. Antioxidants (Basel, Switzerland) 12 (2) (2023)
Andrea Madabeni, Laura Orian
The Key Role of Chalcogenurane Intermediates in the Reduction Mechanism of Sulfoxides and Selenoxides by Thiols Explored In Silico. International journal of molecular sciences 24 (9) (2023)
Andrea Madabeni, Simone Zucchelli, Pablo Andrei Nogara, João B T Rocha, Laura Orian
In the Chalcogenoxide Elimination Panorama: Systematic Insight into a Key Reaction. The Journal of organic chemistry 87 (17) (2022)
Giovanni Ribaudo, Laura Orian
From a Molecule to a Drug: Chemical Features Enhancing Pharmacological Potential. Molecules (Basel, Switzerland) 27 (13) (2022)
Pedro José Tronco Pauletto, Marco Bortoli, Folorunsho Bright Omage, Cássia Pereira Delgado, Pablo Andrei Nogara, Laura Orian, João Batista Teixeira Rocha
In silico analysis of the antidepressant fluoxetine and similar drugs as inhibitors of the human protein acid sphingomyelinase: a related SARS-CoV-2 inhibition pathway. Journal of biomolecular structure & dynamics (2022)
Cássia Pereira Delgado, João Batista Teixeira Rocha, Laura Orian, Marco Bortoli, Pablo Andrei Nogara
In silico studies of M pro and PL pro from SARS-CoV-2 and a new class of cephalosporin drugs containing 1,2,4-thiadiazole. Structural chemistry 33 (6) (2022)
Giovanni Ribaudo, Marco Bortoli, Colby E Witt, Brenna Parke, Sergio Mena, Erika Oselladore, Giuseppe Zagotto, Parastoo Hashemi, Laura Orian
ROS-Scavenging Selenofluoxetine Derivatives Inhibit In Vivo Serotonin Reuptake. ACS omega 7 (10) (2022)
Marco Bortoli, Jonathan Campeggio, Laura Orian, Mirco Zerbetto, Antonino Polimeno
Parameter free evaluation of S N 2 reaction rates for halide substitution in halomethane. Physical chemistry chemical physics : PCCP 24 (12) (2022)
Pablo Andrei Nogara, Folorunsho Bright Omage, Gustavo Roni Bolzan, Cássia Pereira Delgado, Laura Orian, João Batista Teixeira Rocha
Reactivity and binding mode of disulfiram, its metabolites, and derivatives in SARS-CoV-2 PL pro : insights from computational chemistry studies. Journal of molecular modeling 28 (11) (2022)
Giovanni Ribaudo, Marco Bortoli, Erika Oselladore, Alberto Ongaro, Alessandra Gianoncelli, Giuseppe Zagotto, Laura Orian
Selenoxide Elimination Triggers Enamine Hydrolysis to Primary and Secondary Amines: A Combined Experimental and Theoretical Investigation. Molecules (Basel, Switzerland) 26 (9) (2021)
Marco Dalla Tiezza, Friedrich Matthias Bickelhaupt, Leopold Flohé, Laura Orian
Proton Transfer and SN 2 Reactions as Steps of Fast Selenol and Thiol Oxidation in Proteins: A Model Molecular Study Based on GPx. ChemPlusChem 86 (4) (2021)
Pablo Andrei Nogara, Andrea Madabeni, Marco Bortoli, João Batista Teixeira Rocha, Laura Orian
Methylmercury Can Facilitate the Formation of Dehydroalanine in Selenoenzymes: Insight from DFT Molecular Modeling. Chemical research in toxicology 34 (6) (2021)
Cecilia Muraro, Mirko Polato, Marco Bortoli, Fabio Aiolli, Laura Orian
Radical scavenging activity of natural antioxidants and drugs: Development of a combined machine learning and quantum chemistry protocol. The Journal of chemical physics 153 (11) (2021)
Andrea Madabeni, Pablo A Nogara, Marco Bortoli, João Batista Teixeira Rocha, Laura Orian
Effect of Methylmercury Binding on the Peroxide-Reducing Potential of Cysteine and Selenocysteine. Inorganic chemistry 60 (7) (2021)
Marco Dalla Tiezza, Trevor A Hamlin, Friedrich Matthias Bickelhaupt, Laura Orian
Radical Scavenging Potential of the Phenothiazine Scaffold: A Computational Analysis. ChemMedChem (2021)
Laura Orian, Leopold Flohé
Selenium-Catalyzed Reduction of Hydroperoxides in Chemistry and Biology. Antioxidants (Basel, Switzerland) 10 (10) (2021)
Marianna Tosato, Marco Dalla Tiezza, Nóra V May, Abdirisak Ahmed Isse, Sonia Nardella, Laura Orian, Marco Verona, Christian Vaccarin, André Alker, Helmut Mäcke, Paolo Pastore, Valerio Di Marco
Copper Coordination Chemistry of Sulfur Pendant Cyclen Derivatives: An Attempt to Hinder the Reductive-Induced Demetalation in 64/67Cu Radiopharmaceuticals. Inorganic chemistry 60 (15) (2021)
Marianna Tosato, Mattia Asti, Marco Dalla Tiezza, Laura Orian, Daniel Häussinger, Raphael Vogel, Ulli Köster, Mikael Jensen, Alberto Andrighetto, Paolo Pastore, Valerio Di Marco
Highly Stable Silver(I) Complexes with Cyclen-Based Ligands Bearing Sulfide Arms: A Step Toward Silver-111 Labeled Radiopharmaceuticals. Inorganic chemistry 59 (15) (2020)
Giovanni Ribaudo, Marco Bortoli, Chiara Pavan, Giuseppe Zagotto, Laura Orian
Antioxidant Potential of Psychotropic Drugs: From Clinical Evidence to In Vitro and In Vivo Assessment and toward a New Challenge for in Silico Molecular Design. Antioxidants (Basel, Switzerland) 9 (8) (2020)
Giovanni Ribaudo, Marco Bortoli, Alberto Ongaro, Erika Oselladore, Alessandra Gianoncelli, Giuseppe Zagotto, Laura Orian
Fluoxetine scaffold to design tandem molecular antioxidants and green catalysts. RSC advances 10 (32) (2020)
Andrea Madabeni, Marco Dalla Tiezza, Folorunsho Bright Omage, Pablo Andrei Nogara, Marco Bortoli, João Batista Teixeira Rocha, Laura Orian
Chalcogen-mercury bond formation and disruption in model Rabenstein's reactions: A computational analysis. Journal of computational chemistry 41 (23) (2020)
Antonio Barbon, Maria Giulia Dal Farra, Susanna Ciuti, Marco Albertini, Luca Bolzonello, Laura Orian, Marilena Di Valentin
Comprehensive investigation of the triplet state electronic structure of free-base 5,10,15,20-tetrakis(4-sulfonatophenyl)porphyrin by a combined advanced EPR and theoretical approach. The Journal of chemical physics 152 (3) (2020)
Marco Dalla Tiezza, Friedrich Matthias Bickelhaupt, Leopold Flohé, Laura Orian
Proton Transfer and SN 2 Reactions as Steps of Fast Selenol and Thiol Oxidation in Proteins: A Model Molecular Study Based on GPx. ChemPlusChem 86 (4) (2020)
Marco Bortoli, Marco Dalla Tiezza, Cecilia Muraro, Giacomo Saielli, Laura Orian
The 125Te Chemical Shift of Diphenyl Ditelluride: Chasing Conformers over a Flat Energy Surface. Molecules (Basel, Switzerland) 24 (7) (2019)
Alessandro Agostini, Maria Giulia Dal Farra, Harald Paulsen, Antonino Polimeno, Laura Orian, Marilena Di Valentin, Donatella Carbonera
Similarity and Specificity of Chlorophyll b Triplet State in Comparison to Chlorophyll a as Revealed by EPR/ENDOR and DFT Calculations. The journal of physical chemistry. B 123 (39) (2019)
Marco Dalla Tiezza, Friedrich Matthias Bickelhaupt, Laura Orian
Group 9 Metallacyclopentadienes as Key Intermediates in [2+2+2] Alkyne Cyclotrimerizations. Insight from Activation Strain Analyses. Chemphyschem : a European journal of chemical physics and physical chemistry 19 (14) (2018)
Marco Dalla Tiezza, Friedrich Matthias Bickelhaupt, Laura Orian
Half-Sandwich Metal-Catalyzed Alkyne [2+2+2] Cycloadditions and the Slippage Span Model. ChemistryOpen 8 (2) (2018)
Giovanni Ribaudo, Massimo Bellanda, Ileana Menegazzo, Lando P Wolters, Marco Bortoli, Gerardo Ferrer-Sueta, Giuseppe Zagotto, Laura Orian
Mechanistic Insight into the Oxidation of Organic Phenylselenides by H2 O2. Chemistry (Weinheim an der Bergstrasse, Germany) 23 (10) (2017)
Marco Bortoli, Mauro Torsello, Friedrich Matthias Bickelhaupt, Laura Orian
Role of the Chalcogen (S, Se, Te) in the Oxidation Mechanism of the Glutathione Peroxidase Active Site. Chemphyschem : a European journal of chemical physics and physical chemistry 18 (21) (2017)
Laura Orian, Roberto Pilot, Renato Bozio
In Silico Stark Effect: Determination of Excited-State Polarizabilities of Squaraine Dyes. The journal of physical chemistry. A 121 (8) (2017)