PUBLICACIONES PERIODO 2023 – 2020

2023

Photocatalytic C-H Functionalization of Nitrogen Heterocycles Mediated by a Redox Active Protecting Group. M.G. Pizzio, E.G. Mata, P. Dauban, T. Saget Eur. J. Org. Chem.2023, e202300616

 

InCl3-Catalyzed intramolecular Carbonyl−Olefin Metathesis. M.G. Pizzio, Z.B. Cenizo, L. Méndez, AM. Sarotti, E.G. Mata Organic & Biomolecular Chemistry, 202321, 8141-8151. DOI: 10.1039/d3ob01170d.

Elimination of Arsenic Using Sorbents Derived from Chitosan and Iron Oxides, Applying Factorial Designs
Inorganics. Marianela Batistelli; Julián Bultri; Mayra Hernandez Trespalacios; María Florencia Mangiameli; Lina Gribaudo; Sebastián Bellú; María Inés Frascaroli; Juan Carlos González. 2023-11-01. DOI: 10.3390/inorganics1111042

Acid-Promoted Iso-Nazarov Cyclization of Conjugated trans-Dienones and Dienals for the Synthesis of 2-Cyclopentenones. La-Venia, A.; Passaglia, L.; Gurgone, L.; Gandon, V.; Riveira, M. J. J. Org. Chem. 2022, 87, 13469–13479. https://doi.org/10.1021/acs.joc.2c01783


Synthetic Approaches to cis-THC, a Promising Scaffold in Medicinal Chemistry. Gurgone, L.; La-Venia, A.; Caprioglio, D.; Riveira, M. J. Front. Nat. Prod. 2023, 2, doi.org/10.3389/fntpr.2023.1225627.
https://doi.org/10.3389/fntpr.2023.1225627

Two sides of the same coin: Kernel partial least-squares (KPLS) for linear and non-linear multivariate calibration. A tutorial, Allegrini, F, Olivieri, AC, Talanta Open 7 (2023) 100235. https://doi.org/10.1016/j.talo.2023.100235


Spectral pre-processing and non-linear calibration with convolutional kernel partial least-squares. Teaching new tricks to an old dog, Rossi, GB, Lozano, VA, Olivieri, AC, Chemom. Intell. Lab. Syst. 233 (2023) 104736. https://doi.org/10.1016/j.chemolab.2022.104736


Simultaneous quantification of Zr, Mo, U, Np and Pu in technological solutions of spent nuclear fuel reprocessing with a potentiometric multisensor system, Savosina, J, Agafonova-Moroz, M, Naumov, A, Nikolaev, A, Lumpov, A, Babain, V, Legin, A, Olivieri, AC, Parastar, H, Kirsanov, D, Sens. Actuators B Chem. 380 (2023) 133315. https://doi.org/10.1016/j.snb.2023.133315


Aging of malbec wines from Mendoza and California: Evolution of volatile composition, Pellegrino Vidal, R, Boulton, RB, Buscema, F, Olivieri, AC, Am. J. Enol. Vitic. 74 (2023) 0740019. DOI:
10.5344/ajev.2023.22059


An upgrade of MVC2, a MATLAB graphical user interface for second-order multivariate calibration: beyond trilinear models, Chiappini1, FA, Muñoz de la Peña, A, Goicoechea, HC, Olivieri, AC, Chemom. Intell. Lab. Syst. 237 (2023) 104814. https://doi.org/10.1016/j.chemolab.2023.104814


A new constraint to model background signals when processing chromatographic-spectral second-order data with multivariate curve resolution, Carabajal, MD, Pellegrino Vidal, R, Arancibia, JA, Olivieri, AC, Anal. Chim. Acta 1266 (2023) 341354. https://doi.org/10.1016/j.aca.2023.341354


Multivariate optimization of a gas chromatographic method for the determination of organic impurities in ethanol, Nassinia, D, Alvarez, FJ, Bohé, AE, Olivieri, AC, Microchem. J. 194 (2023) 109332. 
https://doi.org/10.1016/j.microc.2023.109332

 

Patriarca, M., Lombardelli, M., Pellegri, N., Daier, V., Signorella, S. R. Exploring the effect of pore size on the activity of superoxide dismutase mimics immobilized in mesoporous spherical silica particles (2023) New Journal of Chemistry 47, pp. 20800-20806. https://doi.org/10.1039/D3NJ03688J

 

Thobokholt, E. N., Simonetti, S. O., Kaufman, T. S., Larghi, E. L., & Bracca, A. B. (2023). Efficient Buchwald–Hartwig and nitrene-mediated five-membered ring closure approaches to the total synthesis of quindoline. Unexpected direct conversion of a nitro group into a phosphazene. RSC advances, 13(20), 13715-13724. https://doi.org/10.1039/D3RA02468G

Ramos Marchena, J. M., Terrestre, G. O., Simonetti, S. O., & Pellegrinet, S. C. (2023). Detours in the Development of the Organocatalytic Diels‐Alder Reactions of Vinylboronic Compounds. A Dead End?. European Journal of Organic Chemistry, 26(8), e202201307. https://doi.org/10.1002/ejoc.202201307

Permingeat Squizatto, C.; Bianchini, M. A.; Delpiccolo, C. M. L. Synthesis of 2, 3-Dihydropyrroles by Rhodium (II)-Catalyzed Transannulation of N-Sulfonyl-1, 2, 3-triazoles: Diversity Generation by One-Pot Methodologies. J. Org. Chem. 2023, 88, 16091. DOI: 10.1021/acs.joc.3c01337

Ruatta, S. M.; Prada Gori, D. N.; Fló Díaz, M.; Lorenzelli, F.; Perelmuter, K.; Alberca, L. N.; Bellera, C.; Medeiros, G.; López, G.V.; Ingol, M.; Porcal, W.; Dibello, E.; Ihnatenko, I.; Kunick, C.; Incerti, M.; Luzardo, M.; Colobbio, M.; Ramos, J.C.; Manta, E., Minini, L.; Lavaggi, M.L.; Hernández, P.; Šarlauskas, J.; Huerta García, C. S.; Castillo, R.; Hernández-Campos, A.; Ribaudo, G.; Zagotto, G.; Carlucci, R.; Medrán, N. S.; Labadie, G.R.; Martinez-Amezaga, M.; Delpiccolo, C.M.L.; Mata, E.G.; Scarone, L.; Posada, L.; Serra, G.;  Calogeropoulou, T.; Prousis, K.; Detsi, A.; Cabrera, M.; Guzmán Alvarez; Aicardo, A.; Araújo, V.; Chavarría, C.; Peterlin Mašič, L.; Gantner, M.E.; Llanos, M.A.; Rodríguez, S.; Gavernet, L.; Park, S.; Heo, J.; Lee, H.; Park, K-H. P.; Bollati-Fogolín, M.; Pritsch, O.; Shum, D.; Alan Talevi. A.; Comini, M. A. Garbage in, garbage out: how reliable training data improved a virtual screening approach against SARS-CoV-2 MPro. Front. Pharmacol. 2023, 14, 1193282. https://doi.org/10.3389/fphar.2023.1193282

Barrionuevo, E.; Cornier, P.G.; Delpiccolo, C.M.L.; Mata, E. G., Roguin, L. P.; Blank, V. C. Antiangiogenic activity of the penicillin derivative TAP7f in melanoma. J Mol Med, 2023, 101, 249. DOI: 10.1007/s00109-023-02287-7

 

 

Richezzi, M., Ferreyra, J., Signorella, S., Palopoli, C., Terrestre, G., Pellegri, N., Hureau, C., Signorella, S. R. Effect of Metal Environment and Immobilization on the Catalytic Activity of a Cu Superoxide Dismutase Mimic (2023) Inorganics 11, art. no. 425 https://doi.org/10.3390/inorganics11110425

 

Richezzi, M., Signorella, S., Palopoli, C., Pellegri, N., Hureau, C., Signorella, S. R. The Critical Role of Ligand Flexibility on the Activity of Free and Immobilized Mn Superoxide Dismutase Mimics (2023) Inorganics 11, art. no. 359 https://doi.org/10.3390/inorganics11090359

 

Bedogni, G., Arrúa, E., Seremeta, K., Okulik, N., Salomon, C. Elucidating the complexation of nifurtimox with cyclodextrins (2023) Journal of Molecular Liquids, 382, art. no. 121852 https://doi.org/10.1016/j.molliq.2023.121852

 

Rojas, D.M.S., Maggio, R.M., Kaufman, T.S. A nuclear magnetic resonance-based study of the behavior of the tautomers of triclabendazole in DMSO-d6, in the presence of water (2023) Journal of Molecular Structure, 1283, art. no. 135315  https://doi.org/10.1016/j.molstruc.2023.135315

 

Chiappini, F.A., Muñoz de la Peña, A., Goicoechea, H.C., Olivieri, A.C. An upgrade of MVC2, a MATLAB graphical user interface for second-order multivariate calibration: Beyond trilinear models (2023) Chemometrics and Intelligent Laboratory Systems, 237, art. no. 104814 https://doi.org/10.1016/j.chemolab.2023.104814

 

Porta, E.O.J., Ballari, M.S., Carlucci, R., Wilkinson, S., Ma, G., Tekwani, B.L., Labadie, G.R. Systematic study of 1,2,3-triazolyl sterols for the development of new drugs against parasitic Neglected Tropical Diseases (2023) European Journal of Medicinal Chemistry, 254, art. no. 115378 https://doi.org/10.1016/j.ejmech.2023.115378

 

Moroni, A.B., Calvo, N.L., Kaufman, T.S. Selected Aspects of the Analytical and Pharmaceutical Profiles of Nifurtimox (2023) Journal of Pharmaceutical Sciences, 112 (6), pp. 1523-1538 https://doi.org/10.1016/j.xphs.2023.02.015

 

Moroni, A.B., Pérez Mayoral, E., Lionello, D.F., Vega, D.R., Kaufman, T.S., Calvo, N.L. Characterization of the hydrochloride salt hemihydrate as a new salt of the antifungal agent tioconazole (2023) International Journal of Pharmaceutics, 637, art. no. 122869 https://doi.org/10.1016/j.ijpharm.2023.122869

 

Dusso, D., Salomon, C.J. Solving the delivery of Lactococcus lactis: Improved survival and storage stability through the bioencapsulation with different carriers (2023) Journal of Food Science, 88 (4), pp. 1495-1505. https://doi.org/10.1111/1750-3841.16538

 

Savosina, J., Agafonova-Moroz, M., Naumov, A., Nikolaev, A., Lumpov, A., Babain, V., Legin, A., Olivieri, A., Parastar, H., Kirsanov, D. Simultaneous quantification of Zr, Mo, U, Np and Pu in technological solutions of spent nuclear fuel reprocessing with a potentiometric multisensor system (2023) Sensors and Actuators B: Chemical, 380, art. no. 133315 https://doi.org/10.1016/j.snb.2023.133315

 

Cortés, I., Sarotti, A.M. E/Z configurational determination of oximes and related derivatives through quantum mechanics NMR calculations: scope and limitations of the leading probabilistic methods (2023) Organic and Biomolecular Chemistry, 21 (14), pp. 2935-2940 https://doi.org/10.1039/d3ob00291h

 

Moroni, A.B., Mayoral, E.P., Lionello, D.F., Vega, D.R., Kaufman, T.S., Calvo, N.L.Solid-state properties of Nifurtimox. Preparation, analytical characterization, and stability of an amorphous phase (2023) European Journal of Pharmaceutics and Biopharmaceutics, 184, pp. 25-35. https://doi.org/10.1016/j.ejpb.2023.01.008

 

Barrionuevo, E., Cornier, P.G., Delpiccolo, C.M.L., Mata, E.G., Roguin, L.P., Blank, V.C. Antiangiogenic activity of the penicillin derivative TAP7f in melanoma (2023) Journal of Molecular Medicine, 101 (3), pp. 249-263 https://doi.org/10.1007/s00109-023-02287-7

 

Ramos Marchena, J.M., Terrestre, G.O., Simonetti, S.O., Pellegrinet, S.C. Detours in the Development of the Organocatalytic Diels-Alder Reactions of Vinylboronic Compounds. A Dead End? (2023) European Journal of Organic Chemistry, 26 (8), art. no. e202201307 https://doi.org/10.1002/ejoc.202201307

 

Rossi, G.B., Lozano, V.A., Olivieri, A.C. Spectral pre-processing and non-linear calibration with convolutional kernel partial least-squares. Teaching new tricks to an old dog (2023) Chemometrics and Intelligent Laboratory Systems, 233, art. no. 104736 https://doi.org/10.1016/j.chemolab.2022.104736

 

Forchetti Casarino, A., Bortolato, S.A., Casis, N., Estenoz, D.A., Spontón, M.E. Novel polybenzoxazine and polybenzoxazine/epoxy thermosetting copolymers containing polysilsesquioxane nanostructures for high-performance thermal protection systems (2023) European Polymer Journal, 182, art. no. 111722  https://doi.org/10.1016/j.eurpolymj.2022.111722

 

Marcarino, M.O., Passaglia, L., Zanardi, M.M., Sarotti, A.M. Breaking the DFT Energy Bias Caused by Intramolecular Hydrogen-Bonding Interactions with MESSI, A Structural Elucidation Method Inspired by Wisdom of Crowd Theory** (2023) Chemistry – A European Journal https://doi.org/10.1002/chem.202300420

 

dos Santos, D.P., Sena, M.M., Almeida, M.R., Mazali, I.O., Olivieri, A.C., Villa, J.E.L. Unraveling surface-enhanced Raman spectroscopy results through chemometrics and machine learning: principles, progress, and trends (2023) Analytical and Bioanalytical Chemistry https://doi.org/10.1007/s00216-023-04620-y

2022

Li, C., Sarotti, A.M., Daranas, A.H., Wu, X., Zheng, S.-L., Blodgett, J.A.V., Cao, S. Chemical Stability of Petrichorins (2022) Journal of Organic Chemistry, 87 (24), pp. 16847-16850 https://doi.org/10.1021/acs.joc.2c01275

 

Labadie, N., Pellegrinet, S.C. Diels-Alder Reactivity of Allenylboronic Acid Pinacol Ester and Related Dienophiles: Mechanistic Studies and Distortion/Interaction-Activation Strain Model Analysis (2022) Journal of Organic Chemistry, 87 (24), pp. 16776-16784.  https://doi.org/10.1021/acs.joc.2c02445

 

Ceccoli, R.D., Bianchi, D.A., Rial, D.V. Sequential chemo-biocatalytic synthesis of aroma compounds (2022) Green Chemistry, 25 (1), pp. 318-329. https://doi.org/10.1039/d2gc02866b

 

Richezzi, M., Palopoli, C., Pellegri, N., Hureau, C., Signorella, S.R. Synthesis, characterization and superoxide dismutase activity of a biomimetic Mn(III) complex covalently anchored to mesoporous silica (2022) Journal of Inorganic Biochemistry, 237, art. no. 112026 https://doi.org/10.1016/j.jinorgbio.2022.112026

 

Bellizzi, Y., Cornier, P.G., Delpiccolo, C.M.L., Mata, E.G., Blank, V., Roguin, L.P. Synergistic antitumor effect of a penicillin derivative combined with thapsigargin in melanoma cells (2022) Journal of Cancer Research and Clinical Oncology, 148 (12), pp. 3361-3373 https://doi.org/10.1007/s00432-022-04129-4

 

Escandar, G.M., Olivieri, A.C. A Critical Review on the Development of Optical Sensors for the Determination of Heavy Metals in Water Samples. the Case of Mercury(II) Ion (2022) ACS Omega, 7 (44), pp. 39574-39585. https://doi.org/10.1021/acsomega.2c05215

 

Cuadrado, C., Daranas, A.H., Sarotti, A.M. May the Force (Field) Be with You: On the Importance of Conformational Searches in the Prediction of NMR Chemical Shifts (2022) Marine Drugs, 20 (11), art. no. 699 https://doi.org/10.3390/md20110699

 

Salazar-Rojas, D., Kaufman, T.S., Maggio, R.M. A study of the heat-mediated phase transformations of praziquantel hydrates. Evaluation of their impact on the dissolution rate (2022) Heliyon, 8 (11), art. no. e11317 https://doi.org/10.1016/j.heliyon.2022.e11317

 

Carlucci, R., Jäger, S.N., Labadie, G.R. Steryl glucosides recovered from biodiesel tank deposits are an excellent source of phytosterols (2022) Industrial Crops and Products, 187, art. no. 115307  https://doi.org/10.1016/j.indcrop.2022.115307

 

Carlucci, R., Di Gresia, G., Mediavilla, M.G., Cricco, J.A., Tekwani, B.L., Khan, S.I., Labadie, G.R. Expanding the scope of novel 1,2,3-triazole derivatives as new antiparasitic drug candidates (2022) RSC Medicinal Chemistry, 14 (1), pp. 122-134 https://doi.org/10.1039/d2md00324d

 

La-Venia, A., Passaglia, L., Gurgone, L., Gandon, V., Riveira, M.J. Acid-Promoted Iso-Nazarov Cyclization of Conjugated trans-Dienones and Dienals for the Synthesis of 2-Cyclopentenones (2022) Journal of Organic Chemistry, 87 (20), pp. 13469-13479 https://doi.org/10.1021/acs.joc.2c01783

 

Tsai, Y.-H., Amichetti, M., Zanardi, M.M., Grimson, R., Daranas, A.H., Sarotti, A.M. ML-J-DP4: An Integrated Quantum Mechanics-Machine Learning Approach for Ultrafast NMR Structural Elucidation (2022) Organic Letters, 24 (41), pp. 7487-7491 https://doi.org/10.1021/acs.orglett.2c01251

 

Vargas, D.F., Kaufman, T.S., Larghi, E.L. Total Synthesis of Aqabamycin G, a Nitrophenyl Indolylmaleimide Marine Alkaloid from Vibrio sp. WMBA (2022) Journal of Organic Chemistry, 87 (20), pp. 13494-13500 https://doi.org/10.1021/acs.joc.2c00063

 

Cornier, P.G., Delpiccolo, C.M.L., Martiren, N.L., Mata, E.G., Mendez, L., Squizatto, C.P., Pizzio, M.G. Transition Metal-Catalyzed Reactions and Solid-Phase Synthesis: A Convenient Blend (2022) European Journal of Organic Chemistry, 2022 (38), art. no. e202200526 https://doi.org/10.1002/ejoc.202200526

 

Anzardi, M.B., Ibañez, G.A., Arancibia, J.A. Quantification chemometrically assisted of veterinary quinolones in edible animal tissues by excitation-emission fluorescence-kinetic data obtained through Fenton degradation (2022) Journal of Food Composition and Analysis, 113, art. no. 104707 https://doi.org/10.1016/j.jfca.2022.104707

 

Allegrini, F., Olivieri, A.C. Linear or non-linear multivariate calibration models? That is the question (2022) Analytica Chimica Acta, 1226, art. no. 340248 https://doi.org/10.1016/j.aca.2022.340248

 

Olivieri, A.C., Sawall, M., Neymeyr, K., Tauler, R. Noise effects on band boundaries in multivariate curve resolution of three-component systems (2022) Chemometrics and Intelligent Laboratory Systems, 228, art. no. 104636 https://doi.org/10.1016/j.chemolab.2022.104636

 

Colque, C.A., albarracín Orio, A.G., Tomatis, P.E., Dotta, G., Moreno, D.M., Hedemann, L.G., Hickman, R.A., Sommer, L.M., Feliziani, S., Moyano, A.J., Bonomo, R.A., Johansen, H.K., Molin, S., Vila, A.J., Smania, A.M. Longitudinal Evolution of the Pseudomonas-Derived Cephalosporinase (PDC) Structure and Activity in a Cystic Fibrosis Patient Treated with β-Lactams (2022) mBio, 13 (5), . https://doi.org/10.1128/mbio.01663-22

 

Arrua, E.C., Hartwig, O., Loretz, B., Goicoechea, H., Murgia, X., Lehr, C.-M., Salomon, C.J. Improving the oral delivery of benznidazole nanoparticles by optimizing the formulation parameters through a design of experiment and optimization strategy  (2022) Colloids and Surfaces B: Biointerfaces, 217, art. no. 112678 https://doi.org/10.1016/j.colsurfb.2022.112678

 

Antonio, M., Carneiro, R.L., Maggio, R.M. A comparative approach of MIR, NIR and Raman based chemometric strategies for quantification of Form I of Meloxicam in commercial bulk drug (2022) Microchemical Journal, 180, art. no. 107575 https://doi.org/10.1016/j.microc.2022.107575

 

Olivieri, A.C. Evaluation of the ambiguity in second-order analytical calibration based on multivariate curve resolution. A tutorial (2022) Microchemical Journal, 179, art. no. 107455, . https://doi.org/10.1016/j.microc.2022.107455

 

Saunthwal, R.K., Saini, K.M., Grimblat, N., Danodia, A.K., Kumar, S., Gandon, V., Verma, A.K. Expedient Access to Polyaromatic Biaryls by Unconventional Ag-Catalyzed Cycloaromatization of Alkynylthiophenes and Au-Catalyzed Double C-H Activation (2022) Organic Letters, 24 (28), pp. 5018-5022. https://doi.org/10.1021/acs.orglett.2c01665

 

Cicetti, S., Maestre, E., Spanevello, R.A., Sarotti, A.M. Towards the Synthesis of Highly Hindered Pyrrolidines by Intramolecular AAC Click Reactions: What Can Be Learned from DFT Calculations?** (2022) European Journal of Organic Chemistry, 2022 (25), art. no. e202200478 https://doi.org/10.1002/ejoc.202200478

 

Brites, N.P., Dilelio, M.C., Schumacher, R.F., Kaufman, T.S., Silveira, C.C. A Convenient Wittig-Horner Mediated Synthesis of 3-Vinylsulfide Derivatives of Indoles (2022) ChemistrySelect, 7 (24), art. no. e202201350 https://doi.org/10.1002/slct.202201350

 

Simonetti, S.O., Kaufman, T.S., Larghi, E.L. Conjugation of Carbohydrates with Quinolines: A Powerful Synthetic Tool (2022) European Journal of Organic Chemistry, 2022 (23), art. no. e202200107 https://doi.org/10.1002/ejoc.202200107

 

Uz Zaman, K.A., Sarotti, A.M., Wu, X., Cao, S. Polyketides, diketopiperazines and an isochromanone from the marine-derived fungal strain Fusarium graminearum FM1010 from Hawaii (2022) Phytochemistry, 198, art. no. 113138 https://doi.org/10.1016/j.phytochem.2022.113138

 

Paulino, É.T., Ribeiro de Lima, M., Viçosa, A.L., Silva, C.H.D., Salomon, C.J., Real, D.A., Leonardi, D., Mello Silva, C.C., Moraes Neto, A.H.A.D. The Effect of Different Formulations of Praziquantel in Reducing Worms in the Prepatent Period of Schistosomiasis in Murine Models (2022) Frontiers in Public Health, 10, art. no. 848633 https://doi.org/10.3389/fpubh.2022.848633

 

Pellieri, C.M., Taddia, A., Loureiro, D.B., Bortolato, S.A., Tubio, G. Spartina argentinensis valorization and process optimization for enhanced production of hydrolytic enzymes by filamentous fungus (2022) Environmental Technology and Innovation, 26, art. no. 102298  https://doi.org/10.1016/j.eti.2022.102298

 

Sperança, M.A., Nascimento, P.A.M., Olivieri, A.C., Pereira, F.M.V. XRF-based analytical methods for supporting sustainability in sugarcane biorefineries (2022) Biofuels, Bioproducts and Biorefining, 16 (3), pp. 758-765 https://doi.org/10.1002/bbb.2336 

 

Li, C., Hu, Y., Wu, X., Stumpf, S.D., Qi, Y., D’Alessandro, J.M., Nepal, K.K., Sarotti, A.M., Cao, S., Blodgett, J.A.V. Discovery of unusual dimeric piperazyl cyclopeptides encoded by a Lentzea flaviverrucosa DSM 44664 biosynthetic supercluster (2022) Proceedings of the National Academy of Sciences of the United States of America, 119 (17), art. no. 2117941119 https://doi.org/10.1073/pnas.2117941119

 

Vázquez, D., Comba, M.B., Spanevello, R.A., Libonatti, B., Mangione, M.I. Insights into the synthesis of hexaaminobenzene hydrochloride: An entry to hexaazatriphenylenes (2022) Journal of Molecular Structure, 1254, art. no. 132385 https://doi.org/10.1016/j.molstruc.2022.132385

 

Andrés Real, D., Gagliano, A., Sonsini, N., Wicky, G., Orzan, L., Leonardi, D., Salomon, C. Design and optimization of pH-sensitive Eudragit nanoparticles for improved oral delivery of triclabendazole (2022) International Journal of Pharmaceutics, 617, art. no. 121594, . https://doi.org/10.1016/j.ijpharm.2022.121594

 

Richezzi, M., Ferreyra, J., Puzzolo, J., Milesi, L., Palopoli, C.M., Moreno, D.M., Hureau, C., Signorella, S.R. Versatile Activity of a Copper(II) Complex Bearing a N4-Tetradentate Schiff Base Ligand with Reduced Oxygen Species (2022) European Journal of Inorganic Chemistry, 2022 (8), art. no. e202101042 https://doi.org/10.1002/ejic.202101042

 

Blanco Ponce, M., Mangione, M.I., Hermosilla Espinosa, R., Torres Rodríguez, E., Ehlers, P., Langer, P. Synthesis and Properties of Thieno[3,2-f]isoquinolines and Benzothieno[3,2-f]isoquinolines (2022) European Journal of Organic Chemistry, 2022 (8), art. no. e202101306 https://doi.org/10.1002/ejoc.202101306

 

Cortés, I., Cabrera-Trujillo, J.J., Fernández, I. Influence of the CH/B replacement on the Reactivity of Boranthrene and Related Compounds (2022) ACS Organic and Inorganic Au, 2 (1), pp. 44-52 https://doi.org/10.1021/acsorginorgau.1c00023

 

Ingrassia, R., Torres, P., Bojanich, L., Ratti, J., Baldor, S., Ramunno, C., Dotta, G., Vidal Tesón, A., Forastieri, P., Soazo, M., Spelzini, D., Narambuena, C., Boeris, V. Concentration of proteins and fat from whey by coacervation: Evaluation of its incorporation in bread (2022) Journal of Food Processing and Preservation, 46 (2), art. no. e16297 https://doi.org/10.1111/jfpp.16297

 

Ferretti, M.D., Rodriguez, M.V., Ferretti, A., Nocito, I., Bettucci, G.R., Srebot, M.S., Larghi, E.L., Martínez, M.L. Antiprotozoal Effect of Baccharis spicata and B. punctulata Volatile Oils and Their Active Components Against Trypanosoma cruzi (2022) Revista Brasileira de Farmacognosia, 32 (1), pp. 133-138. https://doi.org/10.1007/s43450-021-00226-6

 

Dilelio, M.C., Kaufman, T.S., Iglesias, B.A., Silveira, C.C. Synthesis and evaluation of photophysical and electrochemical properties of vinyl chalcogenide derivatives of phenothiazines (2022) Dyes and Pigments, 198, art. no. 109982, . https://doi.org/10.1016/j.dyepig.2021.109982

 

Bellizzi, Y., Anselmi Relats, J.M., Cornier, P.G., Delpiccolo, C.M.L., Mata, E.G., Cayrol, F., Cremaschi, G.A., Blank, V.C., Roguin, L.P. Contribution of endoplasmic reticulum stress, MAPK and PI3K/Akt pathways to the apoptotic death induced by a penicillin derivative in melanoma cells (2022) Apoptosis, 27 (1-2), pp. 34-48. https://doi.org/10.1007/s10495-021-01697-7

 

Terán, L.C., Mortera, P., Tubio, G., Alarcón, S.H., Blancato, V.S., Espariz, M., Esteban, L., Magni, C. Genomic analysis revealed conserved acid tolerance mechanisms from native micro-organisms in fermented feed (2022) Journal of Applied Microbiology, 132 (2), pp. 1152-1165. https://doi.org/10.1111/jam.15292

 

Delbart, D.I., Giri, G.F., Cammarata, A., Pan, M.D., Bareño, L.A., Amigo, N.L., Bechis, A., Suarez, A.G., Spanevello, R.Á., Villaverde, M.S., Todaro, L.B., Urtreger, A.J. Antineoplastic activity of products derived from cellulose-containing materials: levoglucosenone and structurally-related derivatives as new alternatives for breast cancer treatment (2022) Investigational New Drugs, 40 (1), pp. 30-41 https://doi.org/10.1007/s10637-021-01167-6

 

Shariat, K., Kirsanov, D., Olivieri, A.C., Parastar, H. Sensitivity and generalized analytical sensitivity expressions for quantitative analysis using convolutional neural networks (2022) Analytica Chimica Acta, 1192, art. no. 338697 https://doi.org/10.1016/j.aca.2021.338697

 

Darío Pierini, G., Andrés Bortolato, S., Noel Robledo, S., Raquel Alcaraz, M., Fernández, H., Casimiro Goicoechea, H., Alicia Zon, M. Second-order electrochemical data generation to quantify carvacrol in oregano essential oils (2022) Food Chemistry, 368, art. no. 130840 https://doi.org/10.1016/j.foodchem.2021.130840

 

Gonzalez Lopez, E.J., Sarotti, A.M., Martínez, S.R., Macor, L.P., Durantini, J.E., Renfige, M., Gervaldo, M.A., Otero, L.A., Durantini, A.M., Durantini, E.N., Heredia, D.A. BOPHY-Fullerene C60 Dyad as a Photosensitizer for Antimicrobial Photodynamic Therapy (2022) Chemistry – A European Journal, 28 (5), art. no. e202103884 https://doi.org/10.1002/chem.202103884

 

Olivieri, A.C., Neymeyr, K., Sawall, M., Tauler, R. How noise affects the band boundaries in multivariate curve resolution (2022) Chemometrics and Intelligent Laboratory Systems, 220, art. no. 104472 https://doi.org/10.1016/j.chemolab.2021.104472

 

Moroni, A.B., Vega, D.R., Kaufman, T.S., Calvo, N.L. Form quantitation in desmotropic mixtures of albendazole bulk drug by chemometrics-assisted analysis of vibrational spectra (2022) Spectrochimica Acta – Part A: Molecular and Biomolecular Spectroscopy, 265, art. no. 120354 https://doi.org/10.1016/j.saa.2021.120354

 

Zaman, K.H.A.U., Wu, X., Sarotti, A.M., Cao, S. New and bioactive polyketides from Hawaiian marine-derived fungus Trichoderma sp. FM652 (2022) Natural Product Research, 36 (23), pp. 5984-5990 https://doi.org/10.1080/14786419.2022.2056890

 

Marcarino, M.O., Cicetti, S., Zanardi, M.M., Sarotti, A.M. A critical review on the use of DP4+ in the structural elucidation of natural products: The good, the bad and the ugly. A practical guide (2022) Natural Product Reports, 39 (1), pp. 58-76 https://doi.org/10.1039/d1np00030f

 

Larghi, E.L., Bruneau, A., Sauvage, F., Alami, M., Vergnaud-Gauduchon, J., Messaoudi, S. Synthesis and Biological Activity of 3-(Heteroaryl)quinolin-2(1H)-ones Bis-Heterocycles as Potential Inhibitors of the Protein Folding Machinery Hsp90 (2022) Molecules, 27 (2), art. no. 412 https://doi.org/10.3390/molecules27020412

 

Báez, G.D., Llopart, E.E., Berino, R.P., Moro, A., Verdini, R.A., Busti, P.A., Delorenzi, N.J. Characterisation of beta-lactoglobulin/sodium alginate dry films (2022) International Journal of Food Science and Technology, 57 (1), pp. 242-248 https://doi.org/10.1111/ijfs.15402

2021

Cortés, I., Cabrera-Trujillo, J.J., Fernández, I. Rationalizing the influence of α-cationic phospholes on π-catalysis (2021) Dalton Transactions, 50 (48), pp. 18036-18043. https://doi.org/10.1039/d1dt03721h

 

Codina, A.V., Priotti, J., Leonardi, D., Vasconi, M.D., Lamas, M.C., Hinrichsen, L.I. Effect of sex and genotype of the host on the anthelmintic efficacy of albendazole microcrystals, in the CBi-IGE Trichinella infection murine model (2021) Parasitology, 148 (13), pp. 1545-1553. https://doi.org/10.1017/S0031182021001128

 

Chiappini, F.A., Alcaraz, M.R., Escandar, G.M., Goicoechea, H.C., Olivieri, A.C. Chromatographic applications in the multi-way calibration field (2021) Molecules, 26 (21), art. no. 6357 https://doi.org/10.3390/molecules26216357

 

Calvo, N.L., Tejada, G., Svetaz, L.A., Quiroga, A.D., Alvarez, V.A., Lamas, M.C., Leonardi, D.

Development and optimization of a new tioconazole vaginal mucoadhesive film using an experimental design strategy. Physicochemical and biological characterization (2021) Journal of Pharmaceutical and Biomedical Analysis, 205, art. no. 114303 https://doi.org/10.1016/j.jpba.2021.114303

 

Fatthalla, M., Grimblat, N., Brachet, E., Alami, M., Gandon, V., Le Bideau, F., Messaoudi, S. Synthesis of axially chiral biaryl thioglycosides through thiosugar-directed Pd-catalyzed asymmetric C-H activation (2021) Chemical Communications, 57 (80), pp. 10355-10358. https://doi.org/10.1039/d1cc03971g

 

Chiappini, F.A., Gutierrez, F., Goicoechea, H.C., Olivieri, A.C. Achieving the analytical second-order advantage with non-bilinear second-order data (2021) Analytica Chimica Acta, 1181, art. no. 338911 https://doi.org/10.1016/j.aca.2021.338911

 

La–Venia, A., Dzijak, R., Rampmaier, R., Vrabel, M. An Optimized Protocol for the Synthesis of Peptides Containing trans-Cyclooctene and Bicyclononyne Dienophiles as Useful Multifunctional Bioorthogonal Probes (2021) Chemistry – A European Journal, 27 (54), pp. 13632-13641. https://doi.org/10.1002/chem.202102042

 

Olivieri, A.C. Estimating the boundaries of the feasible profiles in the bilinear decomposition of multi-component data matrices (2021) Chemometrics and Intelligent Laboratory Systems, 216, art. no. 104387 https://doi.org/10.1016/j.chemolab.2021.104387

 

Simonetti, S.O., Kaufman, T.S., Rasia, R.M., Sarotti, A.M., Grimblat, N. Thermal decomposition of hexamethylenetetramine: mechanistic study and identification of reaction intermediatesviaa computational and NMR approach (2021) Organic and Biomolecular Chemistry, 19 (34), pp. 7374-7378. https://doi.org/10.1039/d1ob01522b

 

Hinchliffe, P., Moreno, D.M., Rossi, M.-A., Mojica, M.F., Martinez, V., Villamil, V., Spellberg, B., Drusano, G.L., Banchio, C., Mahler, G., Bonomo, R.A., Vila, A.J., Spencer, J. 2-Mercaptomethyl Thiazolidines (MMTZs) Inhibit All Metallo-β-Lactamase Classes by Maintaining a Conserved Binding Mode (2021) ACS Infectious Diseases, 7 (9), pp. 2697-2706. https://doi.org/10.1021/acsinfecdis.1c00194

 

Bhat, A.H., Quiroga, G.N., La-Venia, A., Grover, H.K., Riveira, M.J. Biomimetic Domino Knoevenagel/Cycloisomerization Strategy for the Synthesis of Citridone A and Derivatives (2021) Journal of Organic Chemistry, 86 (17), pp. 12226-12236. https://doi.org/10.1021/acs.joc.1c01542

 

Ferreyra, L.S., Verdini, R.A., Soazo, M., Piccirilli, G.N. Impact of whey protein addition on wheat bread fermented with a spontaneous sourdough (2021) International Journal of Food Science and Technology, 56 (9), pp. 4738-4745.  https://doi.org/10.1111/ijfs.15052

 

Camacho, C.M., Pizzio, M.G., Roces, D.L., Boggián, D.B., Mata, E.G., Bellizzi, Y., Barrionuevo, E., Blank, V.C., Roguin, L.P. Design, synthesis and cytotoxic evaluation of a library of  oxadiazole-containing hybrids (2021) RSC Advances, 11 (47), pp. 29741-29751. https://doi.org/10.1039/d1ra05602f

 

Díaz-Storani, L., Clary, A.A., Moreno, D.M., Ballari, M.S., Porta, E.O.J., Bracca, A.B.J., Johnston, J.B., Labadie, G.R. Synthesis and interaction of terminal unsaturated chemical probes with Mycobacterium tuberculosis CYP124A1 (2021) Bioorganic and Medicinal Chemistry, 44, art. no. 116304 https://doi.org/10.1016/j.bmc.2021.116304

 

Wang, C., Sarotti, A.M., Zaman, K.H.A.U., Wu, X., Cao, S. New Alkaloids From a Hawaiian Fungal Strain Aspergillus felis FM324 (2021) Frontiers in Chemistry, 9, art. no. 724617 https://doi.org/10.3389/fchem.2021.724617

 

Antonio, M., Carneiro, R.L., Maggio, R.M. Unveiling meloxicam monohydrate process of dehydration by an at-line vibrational multi-spectroscopy approach (2021) Journal of Pharmaceutical and Biomedical Analysis, 202, art. no. 114164 https://doi.org/10.1016/j.jpba.2021.114164

 

Vargas, D.F., Larghi, E.L., Kaufman, T.S. Evolution of the Synthesis of Remdesivir. Classical Approaches and Most Recent Advances (2021) ACS Omega, 6 (30), pp. 19356-19363. https://doi.org/10.1021/acsomega.1c03082

 

Wang, C., Zaman, K.H.A., Sarotti, A.M., Wu, X., Zheng, S.-L., Cao, S. NF-κB inhibitory, antimicrobial and antiproliferative potentials of compounds from Hawaiian fungus Aspergillus polyporicola FS910 (2021) 3 Biotech, 11 (8), art. no. 391, . https://doi.org/10.1007/s13205-021-02877-7

 

Labadie, N., Ramos Marchena, J.M., Medrán, N.S., Pellegrinet, S.C. Allenylboronic Acid Pinacol Ester: A Selective Partner for [4 + 2] Cycloadditions (2021) Organic Letters, 23 (13), pp. 5081-5085. https://doi.org/10.1021/acs.orglett.1c01609

 

Ontivero, M.C., Kaufman, T.S., Cortés, I., Bracca, A.B.J. Eco-friendly methoximation of aromatic aldehydes and ketones using MnCl 2.4H 2 O as an easily accessible and efficient catalyst (2021) Royal Society Open Science, 8 (7), art. no. 210142 https://doi.org/10.1098/rsos.210142

 

Martiren, N.L., Bellizzi, Y., Barrionuevo, E., Blank, V.C., Roguin, L.P., Mata, E.G., Cornier, P.G. Design, synthesis and cytotoxic evaluation of peptoid analogs of an anticancer active triazolylpeptidyl penicillin (2021) Future Medicinal Chemistry, 13 (13), pp. 1127-1139. https://doi.org/10.4155/fmc-2020-0379

 

Zanardi, M.M., Sarotti, A.M. Sensitivity Analysis of DP4+ with the Probability Distribution Terms: Development of a Universal and Customizable Method (2021) Journal of Organic Chemistry, 86 (12), pp. 8544-8548.  https://doi.org/10.1021/acs.joc.1c00987

 

Cortés, I., Cordisco, E., Kaufman, T.S., Sortino, M.A., Svetaz, L.A., Bracca, A.B.J. First total synthesis of chromanone A, preparation of related compounds and evaluation of their antifungal activity against Candida albicans, a biofilm forming agen (2021) RSC Advances, 11 (32), pp. 19587-19597  https://doi.org/10.1039/d1ra02553h

 

Forchetti Casarino, A., Bortolato, S.A., Estenoz, D.A., Spontón, M.E. Tuning morphology of siloxane bond-based polybenzoxazines by controlling the sol–gel and curing processes (2021) Polymer Engineering and Science, 61 (6), pp. 1611-1623 https://doi.org/10.1002/pen.25684

 

Chiappini, F.A., Gutierrez, F., Goicoechea, H.C., Olivieri, A.C. Interference-free calibration with first-order instrumental data and multivariate curve resolution. When and why? (2021) Analytica Chimica Acta, 1161, art. no. 338465 https://doi.org/10.1016/j.aca.2021.338465

 

Reddy, D.S., Srinivas, B., Rachineni, K., Jagadeesh, B., Sarotti, A.M., Mohapatra, D.K. BF3·OEt2-Catalyzed Unexpected Stereoselective Formation of z,4-trans-Diallyl-2-methyl-6-aryltetrahydro-2 H-pyrans with Quaternary Stereocenters (2021) Journal of Organic Chemistry, 86 (9), pp. 6518-6527. https://doi.org/10.1021/acs.joc.1c00352

 

Escandar, G.M., Muñoz de la Peña, A. Multi-way calibration for the quantification of polycyclic aromatic hydrocarbons in samples of environmental impact (2021) Microchemical Journal, 164, art. no. 106016 https://doi.org/10.1016/j.microc.2021.106016

 

Olivieri, A.C. A down-to-earth analyst view of rotational ambiguity in second-order calibration with multivariate curve resolution − a tutorial (2021) Analytica Chimica Acta, 1156, art. no. 338206 https://doi.org/10.1016/j.aca.2021.338206

 

Salazar-Rojas, D., Kaufman, T.S., Maggio, R.M. A comprehensive approach toward concomitant triclabendazole polymorphism in pharmaceutical products (2021) Journal of Drug Delivery Science and Technology, 62, art. no. 102386 ttps://doi.org/10.1016/j.jddst.2021.102386

 

Bortolato, S.A., Mancilla Canales, M.A., Riquelme, B.D., Raviola, M., Leguto, A.J., Rebechi, J.P., Ponce de León, P., Korol, A.M. New insights into the analysis of red blood cells from leukemia and anemia patients: Nonlinear quantifiers, fractal mathematics, and Wavelet Transform (2021) Physica A: Statistical Mechanics and its Applications, 567, art. no. 125645, . https://doi.org/10.1016/j.physa.2020.125645

 

Rial, M.S., Seremeta, K.P., Esteva, M.I., Búa, J., Salomon, C.J., Fichera, L.E. In vitro studies and preclinical evaluation of benznidazole microparticles in the acute Trypanosoma cruzi murine model (2021) Parasitology, 148 (5), pp. 566-575. https://doi.org/10.1017/S0031182020002310

 

Batistelli, M., Mora, B.P., Mangiameli, F., Mamana, N., Lopez, G., Goddio, M.F., Bellú, S., González, J.C. A continuous method for arsenic removal from groundwater using hybrid biopolymer-iron-nanoaggregates: improvement through factorial designs (2021) Journal of Chemical Technology and Biotechnology, 96 (4), pp. 923-929.  https://doi.org/10.1002/jctb.6600

 

Jiménez, C.M., Álvarez, H.L., Ballari, M.S., Labadié, G.R., Catalán, C.A.N., Toso, R.E., Sampietro, D.A. Antifungal activity of Euphorbia species against moulds responsible of cereal ear rots (2021) Journal of Applied Microbiology, 130 (4), pp. 1285-1293. https://doi.org/10.1111/jam.14860

 

Fernández, L., Reviglio, A.L., Heredia, D.A., Morales, G.M., Santo, M., Otero, L., Alustiza, F., Liaudat, A.C., Bosch, P., Larghi, E.L., Bracca, A.B.J., Kaufman, T.S. Langmuir-Blodgett monolayers holding a wound healing active compound and its effect in cell culture. A model for the study of surface mediated drug delivery systems (2021) Heliyon, 7 (3), art. no. e06436  https://doi.org/10.1016/j.heliyon.2021.e06436

 

Olivieri, A.C., Tauler, R. N-BANDS: A new algorithm for estimating the extension of feasible bands in multivariate curve resolution of multicomponent systems in the presence of noise and rotational ambiguity (2021) Journal of Chemometrics, 35 (3), art. no. e3317 https://doi.org/10.1002/cem.3317

 

Rossi, M.-A., Martinez, V., Hinchliffe, P., Mojica, M.F., Castillo, V., Moreno, D.M., Smith, R., Spellberg, B., Drusano, G.L., Banchio, C., Bonomo, R.A., Spencer, J., Vila, A.J., Mahler, G. 2-Mercaptomethyl-thiazolidines use conserved aromatic-S interactions to achieve broad-range inhibition of metallo-β-lactamases (2021) Chemical Science, 12 (8), pp. 2898-2908. https://doi.org/10.1039/d0sc05172a

 

Mazivila, S.J., Lombardi, J.M., Páscoa, R.N.M.J., Bortolato, S.A., Leitão, J.M.M., Esteves da Silva, J.C.G. Three-way calibration using PARAFAC and MCR-ALS with previous synchronization of second-order chromatographic data through a new functional alignment of pure vectors for the quantification in the presence of retention time shifts in peak position and shape (2021) Analytica Chimica Acta, 1146, pp. 98-108. https://doi.org/10.1016/j.aca.2020.12.033

 

Ghouilem, J., Tran, C., Grimblat, N., Retailleau, P., Alami, M., Gandon, V., Messaoudi, S. Diastereoselective Pd-Catalyzed Anomeric C(sp3)-H Activation: Synthesis of α-(Hetero)aryl C-Glycosides (2021) ACS Catalysis, 11 (3), pp. 1818-1826. https://doi.org/10.1021/acscatal.0c05052

 

Antonio, M., Raffaghelli, M., Maggio, R.M. Tackling quantitative polymorphic analysis through fixed-dose combination tablets production. Pyrazinamide polymorphic assessment (2021) Journal of Pharmaceutical and Biomedical Analysis, 194, art. no. 113786 https://doi.org/10.1016/j.jpba.2020.113786

 

Shukla, S.N., Gaur, P., Bagri, S.S., Mehrotra, R., Chaurasia, B., Raidas, M.L. Pd(II) complexes with ONN pincer ligand: Tailored synthesis, characterization, DFT, and catalytic activity toward the Suzuki-Miyaura reaction (2021) Journal of Molecular Structure, 1225, art. no. 129071 https://doi.org/10.1016/j.molstruc.2020.129071

 

Mosconi, N., Monti, L., Giulidori, C., Williams, P.A.M., Raimondi, M., Bellú, S., Rizzotto, M. Antifungal, phyto, cyto, genotoxic and lipophilic properties of three complexes of sulfadimethoxine (HSDM) with Ag(I). Synthesis and characterization of [Ag3SDM(SCN)2]·H2O and [Ag2(SDM)2o-phenanthroline]·H2O (2021) Polyhedron, 195, art. no. 114965, . https://doi.org/10.1016/j.poly.2020.114965

 

Daranas, A.H., Sarotti, A.M. Are Computational Methods Useful for Structure Elucidation of Large and Flexible Molecules? Belizentrin as a Case Study (2021) Organic Letters, 23 (2), pp. 503-507 https://doi.org/10.1021/acs.orglett.0c04016

 

Polo, E., Prent-Peñaloza, L., Núñez, Y.A.R., Valdés-Salas, L., Trilleras, J., Ramos, J., Henao, J.A., Galdámez, A., Morales-Bayuelo, A., Gutiérrez, M. Microwave-assisted synthesis, biological assessment, and molecular modeling of aza-heterocycles: Potential inhibitory capacity of cholinergic enzymes to Alzheimer’s disease (2021) Journal of Molecular Structure, 1224, art. no. 129307 https://doi.org/10.1016/j.molstruc.2020.129307

 

Arrua, E.C., Hartwig, O., Ho, D.-K., Loretz, B., Murgia, X., Salomon, C.J., Lehr, C.-M. Surfactant-Free Glibenclamide Nanoparticles: Formulation, Characterization and Evaluation of Interactions with Biological Barriers (2021) Pharmaceutical Research https://doi.org/10.1007/s11095-021-03056-2

 

Shukla, S.N., Gaur, P., Bagri, S.S., Mehrotra, R., Chaurasia, B. Catalytic investigation of Pd(II) complexes over Heck–Mizoroki reaction: Tailored synthesis, characterization and density functional theory (2021) Journal of the Serbian Chemical Society, 86 (3), pp. 269-282. https://doi.org/10.2298/JSC200902075S

 

Fernández de Luco, J., Recio-Balsells, A.I., Ghiano, D.G., Bortolotti, A., Belardinelli, J.M., Liu, N., Hoffmann, P., Lherbet, C., Tonge, P.J., Tekwani, B., Morbidoni, H.R., Labadie, G.R. Exploring the chemical space of 1,2,3-triazolyl triclosan analogs for discovery of new antileishmanial chemotherapeutic agents (2021) RSC Medicinal Chemistry, 12 (1), pp. 120-128. https://doi.org/10.1039/d0md00291g

 

Anzardi, M.B., Arancibia, J.A., Olivieri, A.C. Processing multi-way chromatographic data for analytical calibration, classification and discrimination: A successful marriage between separation science and chemometrics (2021) TrAC – Trends in Analytical Chemistry, 134, art. no. 116128 https://doi.org/10.1016/j.trac.2020.116128

 

Real, D.A., Hoffmann, S., Leonardi, D., Goycoolea, F.M., Salomon, C.J. A quality by design approach for optimization of Lecithin/Span® 80 based nanoemulsions loaded with hydrophobic drugs (2021) Journal of Molecular Liquids, 321, art. no. 114743 https://doi.org/10.1016/j.molliq.2020.114743

 

Solis, C., Durantini, J.E., Macor, L., Heredia, D.A., Gonzalez Lopez, E.J., Durantini, E.N., Mangione, M.I., Rappich, J., Dittrich, T., Otero, L., Gervaldo, M. Electrochemical formation of photoactive organic heterojunctions. Porphyrin-C60 polymeric photoelectrochemical cells (2021) Electrochimica Acta, 365, art. no. 137333 https://doi.org/10.1016/j.electacta.2020.137333

2020

Ghiano, D.G., Recio-Balsells, A., Bortolotti, A., Defelipe, L.A., Turjanski, A., Morbidoni, H.R., Labadie, G.R. New one-pot synthesis of anti-tuberculosis compounds inspired on isoniazid (2020) European Journal of Medicinal Chemistry, 208, art. no. 112699, . https://doi.org/10.1016/j.ejmech.2020.112699

 

Mora, B.P., Bertoni, F.A., Mangiameli, M.F., González, J.C., Bellú, S.E. Batch and fixed-bed column studies of selenite removal from contaminated water by orange peel-based sorbent (2020) Water Science and Engineering, 13 (4), pp. 307-316  https://doi.org/10.1016/j.wse.2020.12.003

 

Durantini, J.E., Rubio, R., Solis, C., Macor, L., Morales, G.M., Mangione, M.I., Heredia, D.A., Durantini, E.N., Otero, L., Gervaldo, M. Electrosynthesis of a hyperbranched dendrimeric porphyrin polymer: Optical and electronic characterization as a material for bifunctional electrochromic supercapacitors (2020) Sustainable Energy and Fuels, 4 (12), pp. 6125-6140. https://doi.org/10.1039/d0se00199f

 

Rojas, A.M.L., Drusin, S.I., Chorostecki, U., Mateos, J.L., Moro, B., Bologna, N.G., Bresso, E.G., Schapire, A., Rasia, R.M., Moreno, D.M., Palatnik, J.F. Identification of key sequence features required for microRNA biogenesis in plants (2020) Nature Communications, 11 (1), art. no. 5320 https://doi.org/10.1038/s41467-020-19129-6

 

Mehrotra, R., Richezzi, M., Palopoli, C., Hureau, C., Signorella, S.R. Effect of coordination dissymmetry on the catalytic activity of manganese catalase mimics (2020) Journal of Inorganic Biochemistry, 213, art. no. 111264 https://doi.org/10.1016/j.jinorgbio.2020.111264

 

Chiappini, F.A., Goicoechea, H.C., Olivieri, A.C. MVC1_GUI: A MATLAB graphical user interface for first-order multivariate calibration. An upgrade including artificial neural networks modelling (2020) Chemometrics and Intelligent Laboratory Systems, 206, art. no. 104162 https://doi.org/10.1016/j.chemolab.2020.104162

 

Taddia, A., Brandaleze, G.N., Boggione, M.J., Bortolato, S.A., Tubio, G. An integrated approach to the sustainable production of xylanolytic enzymes from Aspergillus niger using agro-industrial by-products (2020) Preparative Biochemistry and Biotechnology, 50 (10), pp. 979-991. https://doi.org/10.1080/10826068.2020.1777425

 

Anzardi, M.B., Arancibia, J.A. Chemometrics-assisted liquid chromatographic determination of quinolones in edible animal tissues (2020) Microchemical Journal, 158, art. no. 105138, . https://doi.org/10.1016/j.microc.2020.105138

 

Gonzalez, A.L., Lozano, V.A., Escandar, G.M., Bravo, M.A. Determination of ochratoxin A in coffee and tea samples by coupling second-order multivariate calibration and fluorescence spectroscopy (2020) Talanta, 219, art. no. 121288, . https://doi.org/10.1016/j.talanta.2020.121288

 

Carabajal, M.D., Glorio, A., Marcipar, I.S., Lagier, C.M. Determination of free and total glycerol in biodiesel by spot analysis (2020) Microchemical Journal, 158, art. no. 105148, . https://doi.org/10.1016/j.microc.2020.105148

 

Medrán, N.S., Sayé, M., Pereira, C.A., Tekwani, B.L., La-Venia, A., Labadie, G.R. Expanding the scope of synthetic 1,2,4-trioxanes towards Trypanosoma cruzi and Leishmania donovani (2020) Bioorganic and Medicinal Chemistry Letters, 30 (20), art. no. 127491 https://doi.org/10.1016/j.bmcl.2020.127491

 

Tejada, G., Barrera, M.G., García, P., Sortino, M., Lamas, M.C., Lassalle, V., Alvarez, V., Leonardi, D. Nanoparticulated Systems Based on Natural Polymers Loaded with Miconazole Nitrate and Lidocaine for the Treatment of Topical Candidiasis (2020) AAPS PharmSciTech, 21 (7), art. no. 278 https://doi.org/10.1208/s12249-020-01826-6

 

Soberón, J.R., Sgariglia, M.A., Carabajal Torrez, J.A., Aguilar, F.A., Pero, E.J.I., Sampietro, D.A., Fernández de Luco, J., Labadie, G.R. Antifungal activity and toxicity studies of flavanones isolated from Tessaria dodoneifolia aerial parts (2020) Heliyon, 6 (10), art. no. e05174 https://doi.org/10.1016/j.heliyon.2020.e05174 

 

Rossi, M.G., Soazo, M., Piccirilli, G.N., Llopart, E.E., Revelant, G.C., Verdini, R.A Technological, nutritional and sensorial characteristics of wheat bread fortified with calcium salts (2020) International Journal of Food Science and Technology, 55 (10), pp. 3306-3314 https://doi.org/10.1111/ijfs.14594

 

Schütznerová, E., Přibylka, A., Medran, N.S., Krchňák, V. Greening Solid-Phase Organic Synthesis: Environmentally Conscious Synthesis of Pharmaceutically Relevant Privileged Structures 5,6-Dihydropyridin-2(1 H)-ones and Quinolin-2(1 H)-ones (2020) Journal of Organic Chemistry, 85 (18), pp. 11867-11881 https://doi.org/10.1021/acs.joc.0c01623

 

Chiappini, F.A., Allegrini, F., Goicoechea, H.C., Olivieri, A.C. Sensitivity for Multivariate Calibration Based on Multilayer Perceptron Artificial Neural Networks (2020) Analytical Chemistry, 92 (18), pp. 12265-12272 https://doi.org/10.1021/acs.analchem.0c01863

 

Cortés, I., Cala, L.J., Bracca, A.B.J., Kaufman, T.S. Furo[3,2-: C] coumarins carrying carbon substituents at C-2 and/or C-3. Isolation, biological activity, synthesis and reaction mechanisms (2020) RSC Advances, 10 (55), pp. 33344-33377 https://doi.org/10.1039/d0ra06930b

 

Fargnoli, L., Panozzo-Zénere, E.A., Pagura, L., Barisón, M.J., Cricco, J.A., Silber, A.M., Labadie, G.R. Targeting L-Proline Uptake as New Strategy for Anti-chagas Drug Development (2020) Frontiers in Chemistry, 8, art. no. 696  https://doi.org/10.3389/fchem.2020.00696

 

Olivieri, A.C., Omidikia, N. Initialization effects in two-component second-order multivariate calibration with the extended bilinear model (2020) Analytica Chimica Acta, 1125, pp. 169-176. https://doi.org/10.1016/j.aca.2020.05.060

 

Cortés, I., di Liberto, M.G., Kaufman, T.S., Derita, M.G., Bracca, A.B.J. Synthesis and evaluation of aromatic methoxime derivatives against five postharvest phytopathogenic fungi of fruits. Main structure–activity relationships (2020) Food Chemistry, 321, art. no. 126701, . https://doi.org/10.1016/j.foodchem.2020.126701

 

Bortolotti, A., Vazquez, D.B., Almada, J.C., Inda, M.E., Drusin, S.I., Villalba, J.M., Moreno, D.M., Ruysschaert, J.M., Cybulski, L.E. A transmembrane histidine kinase functions as a pH sensor (2020) Biomolecules, 10 (8), art. no. 1183, pp. 1-11. https://doi.org/10.3390/biom10081183

 

Morri, M., Casabonne, C., Leonardi, D., Vignaduzzo, S. Orphan Formulations for Pediatric Use: Development and Stability Control of Two Sildenafil Citrate Solutions for the Treatment of Pulmonary Hypertension (2020) AAPS PharmSciTech, 21 (6), art. no. 221 https://doi.org/10.1208/s12249-020-01768-z

 

Tsai, Y.-H., Borini Etichetti, C.M., Cicetti, S., Girardini, J.E., Spanevello, R.A., Suárez, A.G., Sarotti, A.M. Design, synthesis and evaluation of novel levoglucosenone derivatives as promising anticancer agents (2020) Bioorganic and Medicinal Chemistry Letters, 30 (14), art. no. 127247 https://doi.org/10.1016/j.bmcl.2020.127247

 

Pellegrino Vidal, R.B., Olivieri, A.C. A New Parameter for Measuring the Prediction Uncertainty Produced by Rotational Ambiguity in Second-Order Calibration with Multivariate Curve Resolution (2020) Analytical Chemistry, 92 (13), pp. 9118-9123 https://doi.org/10.1021/acs.analchem.0c01395

 

Codina, A.V., Priotti, J., Leonardi, D., Vasconi, M.D., Hinrichsen, L.I., Lamas, M.C. Effect of Genotype and Sex of the Host on the Bioavailability of Novel Albendazole Microcrystals Based on Chitosan and Cellulose Derivatives (2020) AAPS PharmSciTech, 21 (5), art. no. 149, . https://doi.org/10.1208/s12249-020-01692-2

 

de Marco, B.A., Maggio, R.M., Nunes Salgado, H.R. Development of a general strategy for the quantification of pseudopolymorphs: analysis of cefadroxil monohydrate in commercial products (2020) Journal of Pharmaceutical Investigation, 50 (4), pp. 425-433 https://doi.org/10.1007/s40005-020-00470-3

 

Simonetti, S.O., Pellegrinet, S.C. Theoretical Study of the Borono-Mannich Reaction with Pinacol Allenylboronate (2020) Journal of Organic Chemistry, 85 (11), pp. 7494-7500. https://doi.org/10.1021/acs.joc.0c01003

 

Sarotti, A.M. Quantum chemical computation and machine learning in NMR (2020) Magnetic Resonance in Chemistry, 58 (6), p. 477 https://doi.org/10.1002/mrc.5016

 

Selvero, M.M., Ledesma, G.N., Abram, U., Schulz-Lang, E., Morel, A.F., Larghi, E.L. 2,2,2-trifluoroethanol-promoted access to symmetrically 3,3-disubstituted quinoline-2,4-diones (2020) Journal of Fluorine Chemistry, 234, art. no. 109520 https://doi.org/10.1016/j.jfluchem.2020.109520

 

Patriarca, M., Daier, V., Camí, G., Rivière, E., Hureau, C., Signorella, S. Preparation, characterization and activity of CuZn and Cu2 superoxide dismutase mimics encapsulated in mesoporous silica (2020) Journal of Inorganic Biochemistry, 207, art. no. 111050. https://doi.org/10.1016/j.jinorgbio.2020.111050

 

Ledesma, J., Boschetti, C.E., Martino, D.M., Bortolato, S.A. Application of thymine-based copolymers in the quantification of organic pollutants in water by sensitized fluorescence (2020) Microchemical Journal, 155, art. no. 104625 https://doi.org/10.1016/j.microc.2020.104625

 

Thobokholt, E.N., Larghi, E.L., Bracca, A.B.J., Kaufman, T.S. Isolation and synthesis of cryptosanguinolentine (isocryptolepine), a naturally-occurring bioactive indoloquinoline alkaloid (2020) RSC Advances, 10 (32), pp. 18978-19002 https://doi.org/10.1039/d0ra03096a

 

Pratesi, D., Matassini, C., Goti, A., Angeli, A., Carta, F., Supuran, C.T., Spanevello, R., Cardona, F. Glycomimetic Based Approach toward Selective Carbonic Anhydrase Inhibitors (2020) ACS Medicinal Chemistry Letters, 11 (5), pp. 727-731 https://doi.org/10.1021/acsmedchemlett.9b00590

 

Vinaud, M.C., Real, D., Fraga, C.M., Lima, N.F., Souza Lino Junior, R.D., Leonardi, D., J Salomon, C. Nanodelivery of nitazoxanide: Impact on the metabolism of Taenia crassiceps cysticerci intracranially inoculated in mice (2020) Therapeutic Delivery, 11 (5), pp. 329-339. https://doi.org/10.4155/tde-2020-0017

 

Marcarino, M.O., Zanardi, M.M., Sarotti, A.M. The Risks of Automation: A Study on DFT Energy Miscalculations and Its Consequences in NMR-based Structural Elucidation (2020) Organic Letters, 22 (9), pp. 3561-3565 https://doi.org/10.1021/acs.orglett.0c01001

 

Rossi, G.B., Lozano, V.A. Simultaneous determination of quality parameters in yerba mate (Ilex paraguariensis) samples by application of near-infrared (NIR) spectroscopy and partial least squares (PLS) (2020) LWT, 126, art. no. 109290 https://doi.org/10.1016/j.lwt.2020.109290

 

Ceccoli, R.D., Bianchi, D.A., Carabajal, M.A., Rial, D.V. Genome mining reveals new bacterial type I Baeyer-Villiger monooxygenases with (bio)synthetic potential (2020) Molecular Catalysis, 486, art. no. 110875 https://doi.org/10.1016/j.mcat.2020.110875

 

Buchter, V., Priotti, J., Leonardi, D., Lamas, M.C., Keiser, J. Preparation, Physicochemical Characterization and In Vitro and In Vivo Activity Against Heligmosomoides polygyrus of Novel Oral Formulations of Albendazole and Mebendazole (2020) Journal of Pharmaceutical Sciences, 109 (5), pp. 1819-1826 https://doi.org/10.1016/j.xphs.2020.02.002

 

Pereira, C.A., Sayé, M., Reigada, C., Silber, A.M., Labadie, G.R., Miranda, M.R., Valera-Vera, E. Computational approaches for drug discovery against trypanosomatid-caused diseases (2020) Parasitology, 147 (6), pp. 611-633 https://doi.org/10.1017/S0031182020000207

 

Olivieri, A.C. Microchemical Journal—Papers on chemometrics (2020) Microchemical Journal, 154, art. no. 104668 https://doi.org/10.1016/j.microc.2020.104668

 

Riveira, M.J. Studies on Biomimetic Singlet Oxygen Oxidations: Application to the Synthesis of the Alkaloid Simulenoline (2020) Journal of Natural Products, 83 (4), pp. 1309-1313. https://doi.org/10.1021/acs.jnatprod.0c00210

 

Salazar-Rojas, D., Maggio, R.M., Kaufman, T.S. Preparation and characterization of a new solid form of praziquantel, an essential anthelmintic drug. Praziquantel racemic monohydrate (2020) European Journal of Pharmaceutical Sciences, 146, art. no. 105267 https://doi.org/10.1016/j.ejps.2020.105267

 

Anzardi, M.B., Arancibia, J.A., Olivieri, A.C. Using chemometric tools to investigate the quality of three- and four-way liquid chromatographic data obtained with two different fluorescence detectors and applied to the determination of quinolone antibiotics in animal tissues (2020) Chemometrics and Intelligent Laboratory Systems, 199, art. no. 103972 https://doi.org/10.1016/j.chemolab.2020.103972

 

Antonelli, T.M., Olivieri, A.C.Developing and Implementing an R Shiny Application to Introduce Multivariate Calibration to Advanced Undergraduate Students (2020) Journal of Chemical Education, 97 (4), pp. 1176-1180 https://doi.org/10.1021/acs.jchemed.9b00850

 

Martinez-Amezaga, M., Giordano, R.A., Prada Gori, D.N., Permingeat Squizatto, C., Giolito, M.V., Scharovsky, O.G., Rozados, V.R., Rico, M.J., Mata, E.G., Delpiccolo, C.M.L. Synthesis of propargylamines: Via the A3 multicomponent reaction and their biological evaluation as potential anticancer agents (2020) Organic and Biomolecular Chemistry, 18 (13), pp. 2475-2486 https://doi.org/10.1039/d0ob00280a

 

Di Liberto, M.G., Caldo, A.J., Quiroga, A.D., Riveira, M.J., Derita, M.G. Zanthosimuline and Related Pyranoquinolines as Antifungal Agents for Postharvest Fruit Disease Control (2020) ACS Omega, 5 (13), pp. 7481-7487 https://doi.org/10.1021/acsomega.0c00225

 

Osella, M.I., Salazar, M.O., Gamarra, M.D., Moreno, D.M., Lambertucci, F., Frances, D.E., Furlan, R.L.E. Arylsulfonyl histamine derivatives as powerful and selective α-glucosidase inhibitors (2020) RSC Medicinal Chemistry, 11 (4), pp. 518-527. https://doi.org/10.1039/c9md00559e

 

Barrera, M.G., Tejada, G., Leonardi, D., Lamas, M.C., Salomón, C.J. A Novel Prototype Device for Microencapsulation of Benznidazole: In Vitro/In Vivo Studies (2020) AAPS PharmSciTech, 21 (3), art. no. 112 https://doi.org/10.1208/s12249-020-01659-3

 

Giolito, M.V., Camacho, C.M., Martinez-Amezaga, M., Traficante, C.I., Giordano, R.A., Cornier, P.G., Mata, E.G., Delpiccolo, C.M.L., Boggián, D.B., Giúdice, A.D., Mainetti, L.E., Scharovsky, O.G., Rozados, V.R., Rico, M.J. Antitumor activity of new chemical compounds in triple negative mammary adenocarcinoma models (2020) Future Science OA, 6 (3), art. no. 0057, . https://doi.org/10.2144/fsoa-2019-0057

 

Olivieri, A.C. Second-order multivariate calibration with the extended bilinear model: Effect of initialization, constraints, and composition of the calibration set on the extent of rotational ambiguity (2020) Journal of Chemometrics, 34 (3), art. no. e3130  https://doi.org/10.1002/cem.3130

 

Barrionuevo, E., Cayrol, F., Cremaschi, G.A., Cornier, P.G., Boggián, D.B., Delpiccolo, C.M.L., Mata, E.G., Roguin, L.P., Blank, V.C. A Penicillin Derivative Exerts an Anti-Metastatic Activity in Melanoma Cells Through the Downregulation of Integrin αvβ3 and Wnt/β-Catenin Pathway (2020) Frontiers in Pharmacology, 11, art. no. 127 https://doi.org/10.3389/fphar.2020.00127

 

Grimblat, N., Sarotti, A.M. Looking at the big picture in activation strain model/energy decomposition analysis: The case of the: Ortho – Para regioselectivity rule in Diels-Alder reactions (2020) Organic and Biomolecular Chemistry, 18 (6), pp. 1104-1111. https://doi.org/10.1039/c9ob02671a

 

Forastieri, P.S., Luna, L.E., Cravero, R.M., Labadie, G.R. A Synthetic Approach to PW2-Like Compounds (2020) ChemistrySelect, 5 (5), pp. 1776-1780 https://doi.org/10.1002/slct.201903654

 

Vignaduzzo, S.E., Maggio, R.M., Olivieri, A.C. Why should the pharmaceutical industry claim for the implementation of second-order chemometric models—A critical review (2020) Journal of Pharmaceutical and Biomedical Analysis, 179, art. no. 112965 https://doi.org/10.1016/j.jpba.2019.112965

 

D’Angelo, M., Martino, G.P., Blancato, V.S., Espariz, M., Hartke, A., Sauvageot, N., Benachour, A., Alarcón, S.H., Magni, C. Diversity of volatile organic compound production from leucine and citrate in Enterococcus faecium (2020) Applied Microbiology and Biotechnology, 104 (3), pp. 1175-1186 https://doi.org/10.1007/s00253-019-10277-4

 

Drusin, S.I., Rasia, R.M., Moreno, D.M. Study of the role of Mg2+ in dsRNA processing mechanism by bacterial RNase III through QM/MM simulations (2020) Journal of Biological Inorganic Chemistry, 25 (1), pp. 89-98 https://doi.org/10.1007/s00775-019-01741-7

 

Alcaraz, M.R., Culzoni, M.J., Ibañez, G.A., Lozano, V.A., Olivieri, A.C. On second-order calibration based on multivariate curve resolution in the presence of highly overlapped profiles (2020) Analytica Chimica Acta, 1096, pp. 53-60 https://doi.org/10.1016/j.aca.2019.10.053

 

Camí, G.E., Brusau, E.V., Narda, G.E., Maggio, R.M. Dual approach for concomitant monitoring of dissolution and transformation at solid-state. Mebendazole salts case study (2020) Journal of Drug Delivery Science and Technology, 55, art. no. 101344 https://doi.org/10.1016/j.jddst.2019.101344

 

Parodi, A.R., Merlo, C., Córdoba, A., Palopoli, C., Ferreyra, J., Signorella, S., Ferreira, M.L., Magario, I. Application of metal complexes as biomimetic catalysts on glycerol oxidation (2020) Molecular Catalysis, 481, art. no. 110236 https://doi.org/10.1016/j.mcat.2018.11.007

 

Zanardi, M.M., Marcarino, M.O., Sarotti, A.M. Redefining the Impact of Boltzmann Analysis in the Stereochemical Assignment of Polar and Flexible Molecules by NMR Calculations (2020) Organic Letters, 22 (1), pp. 52-56 https://doi.org/10.1021/acs.orglett.9b03866

 

Allegrini, F., Olivieri, A.C. 2.20 – Figures of Merit (2020) Comprehensive Chemometrics: Chemical and Biochemical Data Analysis, Second Edition: Four Volume Set, 2, pp. 441-463. https://doi.org/10.1016/B978-0-12-409547-2.14612-8

 

Vallejos, M.M., Labadie, G.R.Insight into the factors controlling the equilibrium of allylic azides (2020) RSC Advances, 10 (8), pp. 4404-4413 https://doi.org/10.1039/c9ra10093h

 

Vargas, D.F., Romero, B.S., Larghi, E.L., Kaufman, T.S. Rhodium(III)-Catalyzed C-H Activation-Based First Total Synthesis of 6- O -Methyl Anciscochine, an Alkaloid Isolated from Ancistrocladus tectorius (2020) Synthesis (Germany), 52 (1), art. no. ss-2019-m0489-op, pp. 119-126 https://doi.org/10.1055/s-0039-1690701

 

Real, D., Orzan, L., Leonardi, D., Salomon, C.J. Improving the Dissolution of Triclabendazole from Stable Crystalline Solid Dispersions Formulated for Oral Delivery (2020) AAPS PharmSciTech, 21 (1), art. no. 16 https://doi.org/10.1208/s12249-019-1551-4

 

García, A., Pérez, L.M., Piccirilli, G.N., Verdini, R.A. Evaluation of antioxidant, antibacterial and physicochemical properties of whey protein-based edible films incorporated with different soy sauces (2020) LWT, 117, art. no. 108587 https://doi.org/10.1016/j.lwt.2019.108587