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Antiviral agents against COVID-19: structure-based design of specific peptidomimetic inhibitors of SARS-CoV-2 main protease

RSC advances, 2020-11, Vol.1 (66), p.4244-4263

2020

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Selective inhibitors of zinc-dependent histone deacetylases. Therapeutic targets relevant to cancer

Current pharmaceutical design, 2015-01, Vol.21 (11), p.1472-1502

2015

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Structure-Based Design and Pharmacophore-Based Virtual Screening of Combinatorial Library of Triclosan Analogues Active against Enoyl-Acyl Carrier Protein Reductase of Plasmodium falciparum with Favourable ADME Profiles

International journal of molecular sciences, 2023-04, Vol.24 (8), p.6916

2023

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Design of inhibitors of SARS-CoV-2 papain-like protease deriving from GRL0617: Structure–activity relationships

Bioorganic & medicinal chemistry, 2024-11, Vol.113, p.117909, Article 117909

2024

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Inhibitors of HIV-protease from computational design. A history of theory and synthesis still to be fully appreciated

Current pharmaceutical design, 2014-01, Vol.20 (21), p.3398-3411

2014

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Drugs against avian influenza a virus: design of novel sulfonate inhibitors of neuraminidase N1

Current pharmaceutical design, 2014-01, Vol.20 (21), p.3478-3487

2014

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Bioresource of Antioxidant and Potential Medicinal Compounds from Waste Biomass of Spruce

ACS sustainable chemistry & engineering, 2017-09, Vol.5 (9), p.8161-8170

2017

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Structure-Based Design and in Silico Screening of Virtual Combinatorial Library of Benzamides Inhibiting 2-trans Enoyl-Acyl Carrier Protein Reductase of Mycobacterium tuberculosis with Favorable Predicted Pharmacokinetic Profiles

International journal of molecular sciences, 2019-09, Vol.20 (19), p.4730

2019

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Stereoisomers of oseltamivir - synthesis, in silico prediction and biological evaluation

Organic & biomolecular chemistry, 2017-02, Vol.15 (8), p.1828-1841

2017

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Pathogenicity of new BEST1 variants identified in Italian patients with best vitelliform macular dystrophy assessed by computational structural biology

Journal of translational medicine, 2019-10, Vol.17 (1), p.330-330, Article 330

2019

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Virtual design of novel Plasmodium falciparum cysteine protease falcipain-2 hybrid lactone-chalcone and isatin-chalcone inhibitors probing the S2 active site pocket

Journal of enzyme inhibition and medicinal chemistry, 2019-01, Vol.34 (1), p.547-561

2019

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Diversity of sialidases found in the human body – A review

International journal of biological macromolecules, 2020-04, Vol.148, p.857-868

2020

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How accurate is the description of ligand–protein interactions by a hybrid QM/MM approach?

Journal of molecular modeling, 2018-01, Vol.24 (1), p.11-20, Article 11

2018

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Computer-Aided Design of Orally Bioavailable Pyrrolidine Carboxamide Inhibitors of Enoyl-Acyl Carrier Protein Reductase of Mycobacterium tuberculosis with Favorable Pharmacokinetic Profiles

International journal of molecular sciences, 2015-12, Vol.16 (12), p.29744-29771

2015

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QSAR analysis of antimicrobial and haemolytic effects of cyclic cationic antimicrobial peptides derived from protegrin-1

Bioorganic & medicinal chemistry, 2006-09, Vol.14 (17), p.6065-6074

Frecer, Vladimir

2006

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Diarylcyclopropane hydroxamic acid inhibitors of histone deacetylase 4 designed by combinatorial approach and QM/MM calculations

Journal of molecular graphics & modelling, 2018-10, Vol.85, p.97-110

2018

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Development of a novel diagnostic algorithm to predict NASH in HCV-positive patients

The International journal of biological markers, 2018-05, Vol.33 (2), p.231-236

2018

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Molecular Interfaces of the Galactose-binding Protein Tectonin Domains in Host-Pathogen Interaction

The Journal of biological chemistry, 2010-03, Vol.285 (13), p.9898-9907

2010

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Ultraviolet A radiation potentiates the cytotoxic and genotoxic effects of 7 H-dibenzo[c,g]carbazole and its methyl derivatives

Environmental and molecular mutagenesis, 2015-05, Vol.56 (4), p.388-403

2015

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Identification and evaluation of antiviral activity of novel compounds targeting SARS-CoV-2 virus by enzymatic and antiviral assays, and computational analysis

Journal of enzyme inhibition and medicinal chemistry, 2024-12, Vol.39 (1), p.2301772-2301772

2024

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Combinatorial design of avian influenza neuraminidase inhibitors containing pyrrolidine core with a reduced susceptibility to viral drug resistance

Combinatorial chemistry & high throughput screening, 2010-03, Vol.13 (3), p.268-277

2010

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Three-component reaction and organocatalysis in one: synthesis of densely substituted 4-aminochromanes

Tetrahedron, 2016-11, Vol.72 (47), p.7620-7627

2016

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The Effects of Combinatorial Chemistry and Technologies on Drug Discovery and Biotechnology – a Mini Review

Nova Biotechnologica et Chimica, 2014-12, Vol.13 (2), p.87-108

2014

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A novel human tectonin protein with multivalent beta-propeller folds interacts with ficolin and binds bacterial LPS

PloS one, 2009-07, Vol.4 (7), p.e6260-e6260

2009

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Design of novel dihydroxynaphthoic acid inhibitors of Plasmodium falciparum lactate dehydrogenase

Medicinal chemistry (Shp-sariqah, United Arab Emirates), 2012-09, Vol.8 (5), p.970-984

2012

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Antiviral agents against COVID-19: structure-based design of specific peptidomimetic inhibitors of SARS-CoV-2 main protease

Selective inhibitors of zinc-dependent histone deacetylases. Therapeutic targets relevant to cancer

Structure-Based Design and Pharmacophore-Based Virtual Screening of Combinatorial Library of Triclosan Analogues Active against Enoyl-Acyl Carrier Protein Reductase of Plasmodium falciparum with Favourable ADME Profiles

Design of inhibitors of SARS-CoV-2 papain-like protease deriving from GRL0617: Structure–activity relationships

Inhibitors of HIV-protease from computational design. A history of theory and synthesis still to be fully appreciated

Drugs against avian influenza a virus: design of novel sulfonate inhibitors of neuraminidase N1

Bioresource of Antioxidant and Potential Medicinal Compounds from Waste Biomass of Spruce

Structure-Based Design and in Silico Screening of Virtual Combinatorial Library of Benzamides Inhibiting 2-trans Enoyl-Acyl Carrier Protein Reductase of Mycobacterium tuberculosis with Favorable Predicted Pharmacokinetic Profiles

Stereoisomers of oseltamivir - synthesis, in silico prediction and biological evaluation

Pathogenicity of new BEST1 variants identified in Italian patients with best vitelliform macular dystrophy assessed by computational structural biology

Virtual design of novel Plasmodium falciparum cysteine protease falcipain-2 hybrid lactone-chalcone and isatin-chalcone inhibitors probing the S2 active site pocket

Diversity of sialidases found in the human body – A review

How accurate is the description of ligand–protein interactions by a hybrid QM/MM approach?

Computer-Aided Design of Orally Bioavailable Pyrrolidine Carboxamide Inhibitors of Enoyl-Acyl Carrier Protein Reductase of Mycobacterium tuberculosis with Favorable Pharmacokinetic Profiles

QSAR analysis of antimicrobial and haemolytic effects of cyclic cationic antimicrobial peptides derived from protegrin-1

Diarylcyclopropane hydroxamic acid inhibitors of histone deacetylase 4 designed by combinatorial approach and QM/MM calculations

Development of a novel diagnostic algorithm to predict NASH in HCV-positive patients

Molecular Interfaces of the Galactose-binding Protein Tectonin Domains in Host-Pathogen Interaction

Ultraviolet A radiation potentiates the cytotoxic and genotoxic effects of 7 H-dibenzo[c,g]carbazole and its methyl derivatives

Identification and evaluation of antiviral activity of novel compounds targeting SARS-CoV-2 virus by enzymatic and antiviral assays, and computational analysis

Combinatorial design of avian influenza neuraminidase inhibitors containing pyrrolidine core with a reduced susceptibility to viral drug resistance

Three-component reaction and organocatalysis in one: synthesis of densely substituted 4-aminochromanes

The Effects of Combinatorial Chemistry and Technologies on Drug Discovery and Biotechnology – a Mini Review

A novel human tectonin protein with multivalent beta-propeller folds interacts with ficolin and binds bacterial LPS

Design of novel dihydroxynaphthoic acid inhibitors of Plasmodium falciparum lactate dehydrogenase

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