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List of works by Bogdan I Iorga

(+)- and (-)-Ecarlottones, Uncommon Chalconoids from Fissistigma latifolium with Pro-Apoptotic Activity

scientific article published on 21 November 2017

A new access to dihydrotropones through ring expansion of spirocyclohexadienones: synthesis and mechanism

scientific article published on 27 July 2007

Acridone alkaloids from Glycosmis chlorosperma as DYRK1A inhibitors

scientific article published on 05 May 2014

Advanced Structural Determination of Diterpene Esters Using Molecular Modeling and NMR Spectroscopy.

scientific article

Benzofurans from Styrax agrestis as acetylcholinesterase inhibitors: structure-activity relationships and molecular modeling studies

scientific article published on 22 September 2011

Beta-lactamase database (BLDB) - structure and function.

scientific article published on December 2017

Bicyclic and tetracyclic diterpenes from a Trichoderma symbiont of Taxus baccata.

scientific article

Biochemical and Structural Characterization of OXA-405, an OXA-48 Variant with Extended-Spectrum β-Lactamase Activity

scientific article published on 21 December 2019

Bivalent sequential binding of docetaxel to methyl-β-cyclodextrin ⬇️

scientific article published on June 25, 2011

Blind Pose Prediction, Scoring, and Affinity Ranking of the CSAR 2014 Dataset.

scientific article published on 22 September 2015

Blinded evaluation of cathepsin S inhibitors from the D3RGC3 dataset using molecular docking and free energy calculations

scientific article published on 11 September 2018

Blinded evaluation of farnesoid X receptor (FXR) ligands binding using molecular docking and free energy calculations.

scientific article published on 02 September 2017

Carbonic anhydrase activators: synthesis of high affinity isozymes I, II and IV activators, derivatives of 4-(4-tosylureido-amino acyl)ethyl-1H-imidazole (histamine derivatives)

scientific article published on 01 January 2000

Carbonic anhydrase binding site parameterization in OPLS-AA force field

scientific article published on 02 November 2012

Characterization of BRPMBL, the Bleomycin Resistance Protein Associated with the Carbapenemase NDM

scientific article published on 9 January 2017

Class C β-Lactamases: Molecular Characteristics

scientific article published in 2022

Cyclic imine toxins from dinoflagellates: a growing family of potent antagonists of the nicotinic acetylcholine receptors

scientific article published on 21 March 2017

Defining the function of OmpA in the Rcs stress response

scientific article published on 28 September 2020

Defining the function of OmpA in the Rcs stress response

preprint article published on 16 July 2020

Deleting a Chromatin Remodeling Gene Increases the Diversity of Secondary Metabolites Produced by Colletotrichum higginsianum ⬇️

scientific article published on 18 February 2019

Evaluation of docking performance in a blinded virtual screening of fragment-like trypsin inhibitors ⬇️

scientific article published on December 17, 2011

Fast synthesis of complex enantiopure heterocyclic scaffolds by a tandem sequence of simple transformations on α-hydroxyaldehydes

scientific article published on 10 June 2013

From Synthetic Simplified Marine Metabolite Analogues to New Selective Allosteric Inhibitor of Aurora B Kinase

scientific article published on 08 January 2021

From enantiopure hydroxyaldehydes to complex heterocyclic scaffolds: development of domino Petasis/Diels-Alder and cross-metathesis/Michael addition reactions

scientific article published on 05 August 2014

From meiogynin A to the synthesis of dual inhibitors of Bcl-xL and Mcl-1 anti-apoptotic proteins

scientific article published on 01 August 2014

Genetic and Biochemical Characterization of OXA-519, a Novel OXA-48-Like β-Lactamase

scholarly article by Laura Dabos et al published August 2018 in Antimicrobial Agents and Chemotherapy

Genetic and Biochemical Characterization of OXA-535, a Distantly Related OXA-48-Like β-Lactamase

scientific article published on 24 September 2018

Genetic, Biochemical, and Structural Characterization of CMY-136 β-Lactamase, a Peculiar CMY-2 Variant

scientific article published on 07 March 2019

How the assembly and protection of the bacterial cell envelope depend on cysteine residues

scientific article published on 02 June 2020

Interplay between the hinge region of iron sulphur protein and the Qo site in the bc1 complex - Analysis of Plasmodium-like mutations in the yeast enzyme

scientific article published on 21 August 2015

Investigation of the complexation of albendazole with cyclodextrins for the design of new antiparasitic formulations.

scientific article

Isolation and characterization of unusual hydrazides from Streptomyces sp. impact of the cultivation support and extraction procedure.

scientific article

Ligandbook: an online repository for small and drug-like molecule force field parameters.

scientific article

Molecular docking performance evaluated on the D3R Grand Challenge 2015 drug-like ligand datasets

scientific article

NADH oxidase activity of Bacillus subtilis nitroreductase NfrA1: insight into its biological role

scientific article

New potent human acetylcholinesterase inhibitors in the tetracyclic triterpene series with inhibitory potency on amyloid β aggregation

scientific article published on 23 March 2011

Performance evaluation of molecular docking and free energy calculations protocols using the D3R Grand Challenge 4 dataset

scientific article published on 01 November 2019

Poly(γ-benzyl-L-glutamate)-PEG-alendronate multivalent nanoparticles for bone targeting.

scientific article

Prediction of cyclohexane-water distribution coefficients for the SAMPL5 data set using molecular dynamics simulations with the OPLS-AA force field.

scientific article

Prediction of hydration free energies for aliphatic and aromatic chloro derivatives using molecular dynamics simulations with the OPLS-AA force field

article

Prediction of hydration free energies for the SAMPL4 diverse set of compounds using molecular dynamics simulations with the OPLS-AA force field

article

Prediction of octanol-water partition coefficients for the SAMPL6-[Formula: see text] molecules using molecular dynamics simulations with OPLS-AA, AMBER and CHARMM force fields

scientific article published on 20 January 2020

Pro-apoptotic meiogynin A derivatives that target Bcl-xL and Mcl-1.

scientific article published on 6 September 2014

Prorocentrolide-A from Cultured Prorocentrum lima Dinoflagellates Collected in Japan Blocks Sub-Types of Nicotinic Acetylcholine Receptors

scientific article published on 28 February 2018

Regio-, Diastereo-, and Enantioselective Nitroso-Diels-Alder Reaction of 1,3-Diene-1-carbamates Catalyzed by Chiral Phosphoric Acids

scientific article published on 11 September 2015

Rigid Analogues of Antimitotic Indolobenzazepinones: New Insights into Tubulin Binding via Molecular Modeling

scientific article

SAMPL6: calculation of macroscopic pKa values from ab initio quantum mechanical free energies

Saccharomyces cerevisiae-based mutational analysis of the bc1 complex Qo site residue 279 to study the trade-off between atovaquone resistance and function.

scientific article published on 27 April 2015

Selective trihydroxylated azepane inhibitors of NagZ, a glycosidase involved in Pseudomonas aeruginosa resistance to β-lactam antibiotics.

scientific article

Stability of cyclic imine toxins: interconversion of pinnatoxin amino ketone and pinnatoxin A in aqueous media.

scientific article published on 6 November 2012

Structural and Functional Aspects of Class A Carbapenemases

scientific article

Structural insight into the formation of lipoprotein-β-barrel complexes

scientific article published on 22 June 2020

Substrate Specificity of OXA-48 after β5-β6 Loop Replacement

scientific article published on 19 March 2020

Synthesis, biological evaluation, and molecular modeling of natural and unnatural flavonoidal alkaloids, inhibitors of kinases.

scientific article

Synthetic Pinnatoxins A and G Reversibly Block Mouse Skeletal Neuromuscular Transmission In Vivo and In Vitro

scientific article published on 24 May 2019

The Dinoflagellate Toxin 20-Methyl Spirolide-G Potently Blocks Skeletal Muscle and Neuronal Nicotinic Acetylcholine Receptors

scientific article published on 24 August 2016

The Neurotoxic Effect of 13,19-Didesmethyl and 13-Desmethyl Spirolide C Phycotoxins Is Mainly Mediated by Nicotinic Rather Than Muscarinic Acetylcholine Receptors.

scientific article

The antimalarial compound ELQ-400 is an unusual inhibitor of the bc1 complex, targeting both Qo and Qi sites

scientific article published on 25 March 2018

The unexpected increase of clotrimazole apparent solubility using randomly methylated β-cyclodextrin

scientific article

Total Synthesis of Pinnatoxins A and G and Revision of the Mode of Action of Pinnatoxin A ⬇️

scientific article published on June 17, 2011

Virtual screening of the SAMPL4 blinded HIV integrase inhibitors dataset.

scientific article published on 24 January 2014

mTOR Inhibition via Displacement of Phosphatidic Acid Induces Enhanced Cytotoxicity Specifically in Cancer Cells

scientific article published on 27 July 2018

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