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Scientific Publications

Papers in Peer Review Journals

  • Renny Mathew, Ivan V. Sergeyev, Fabien Aussenac, Lydia Gkoura, Melanie Rosay, Maria Baias, Complete resonance assignment of a pharmaceutical drug at natural isotopic abundance from DNP-Enhanced solid-state NMR  Solid State Nuclear Magnetic Resonance 119 (2022) 101794

  • Abdul Khayum Mohammed, Ayesha A. Al Khoori, Matthew A. Addicoat, Sabu Varghese, Israa Othman, Maguy Abi Jaoude, Kyriaki Polychronopoulou, Maria Baias, Mohammad Abu Haija, DineshShetty, Solvent-Influenced Fragmentations in Free-Standing Three-Dimensional Covalent Organic Framework Membranes for Hydrophobicity Switching – Angew. Chem. Int. Ed. 61 (2022) e202200905

  • Bikash Garai, Dinesh Shetty, Tina Skorjanc, Felipe Gándara, Nawavi Naleem, Sabu Varghese, Sudhir Kumar Sharma, Maria Baias, Ramesh Jagannathan, Mark A. Olson, Serdal Kirmizialtin, Ali Trabolsi, Taming the Topology of Calix[4]arene-Based 2D-Covalent Organic Frameworks: Interpenetrated vs Noninterpenetrated Frameworks and Their Selective Removal of Cationic Dyes – J. Am. Chem. Soc. 143 (2021) 3407-3415

  • Wegood M. Awad, Maria Baias, How Mobile NMR can Help with the Conservation of Paintings – Magn. Reson. Chem. (2020)

  • Bernhard Blümich, Maria Baias, Christian Rehorn, Valeria Gabrielli, Denis Jaschtschuk, Colin Harrison, Claudia Invernizzi, Marco Malagodi, Comparison of historical violins by non-destructive MRI depth profiling – Microchem. J. (2020)

  • Renny Mathew, Karolina A. Uchman, Lydia Gkoura, Chris J. Pickard, Maria Baias, Identifying Aspirin Polymorphs from Combined DFT‐Based Crystal Structure Prediction and Solid‐State NMR – Magn. Reson. Chem. (2020) 1-8 – Special Issue invited research article

  • Gobinda Das, Thirumurugan Prakasam, Matthew A. Addicoat, Sudhir Kumar Sharma, Florent RAVAUX, Renny Mathew, Maria Baias, Ramesh Jagannathan, Mark A. Olson, Ali Trabolsi, Azobenzene-Equipped Covalent Organic Framework: Light-Operated Reservoir – J. Am. Chem. Soc. 141 (2019) 19078-19087

  • Gobinda Das, Sudhir Kumar Sharma, Thirumurugan Prakasam, Felipe Gándara, Renny Mathew, Nour Alkhatib, Na’il Saleh, Renu Pasricha, John-Carl Olsen, Maria Baias, Serdal Kirmizialtin, Ramesh Jagannathan, Ali Trabolsi, A polyrotaxanated covalent organic network basedon viologen and cucurbit[7]uril – Comms. Chem. 2 (2019) 106

  • Maria Baias, NMR Crystallography – Magn. Reson. Chem. – editorial for the special issue on NMR Crystallography

  • Maria Baias, Mobile NMR: An Essential Tool for Protecting our Cultural Heritage – Magn. Reson. Chem. 55 (2017) 33-37 – Special Issue perspective article

  • Maria Baias, Pieter E.S Smith, Koning Shen, Lukasz A. Joachimiak, Szymon Żerko, Wiktor Koźmiński, Judith Frydman, Lucio Frydman, Structure and Dynamics of the Huntingtin Exon-1 N-Terminus: A Solution NMR Perspective – J. Am. Chem. Soc. 139 (2017) 1168-1176

  • Judith Schlagnitweit, Mingxue Tang, Maria Baias, Sara Richardson, Staffan Schantz, Lyndon Emsley, Nanostructure of Materials Determined by Relayed Paramagnetic Relaxation Enhancement – J. Am. Chem. Soc. 137 (2015) 12482-12485

  • Judith Schlagnitweit, Mingxue Tang, Maria Baias, Sara Richardson, Staffan Schantz, Lyndon Emsley, A solid-state NMR method to determine domain sizes in multi-component polymer formulations – J. Magn. Reson. 261 (2015) 43-48

  • Maria Baias, Anne Lesage, Sonia Augado, Jerome Canivet, Virginie Moizan-Basle, Nathalie Audebrand, David Farrusseng, Lyndon Emsley, Superstructure of a Substituted Zeolitic Imidazolate Metal Organic Framework Determined by Combining Proton Solid-State NMR Spectroscopy and DFT Calculations – Angew. Chem. Int. Ed. 54 (2015) 5971-5976

  • Maria Baias, Jean-Nicolas Dumez, Per H. Svensson, Staffan Schantz, Graeme M. Day, Lyndon Emsley, De novo determination of the crystal structure of a large drug molecule by crystal-structure prediction-based powder NMR crystallography – J. Am. Chem. Soc. 135 (2013) 17501-17507 – highlighted in ACS Chemical and Engineering News

  • Pieter E. E. Smith, Kevin J. Donovan, Or Szekely, Maria Baias, Lucio Frydman, Ultrafast NMR T1 Relaxation Measurements: Probing Molecular Properties in Real Time – Chem. Phys. Chem. 14(13) (2013) 3138-3145

  • Anusree Kuttatheyil, Daniel Laessig, Joerg Lincke, Merten Kobalz, Maria Baias, Harald Krautscheid, Chris J. Pickard, Juergen Hasse, Marko Bertmer, Synthesis, Crystal Structure and Solid State NMR Investigations of Heteronuclear Zn/Co MOFs – A Comparative Study – Inorg. Chem. 52 (2013) 4431-4442

  • Maria Baias, Jean-Nicolas Dumez, Cory M. Widdifield, Timothy G. Cooper, Elodie Salager, Sirena Bassil, Robin S. Stein, Anne Lesage, Graeme M. Day, Lyndon Emsley, Powder crystallography of pharmaceutical materials by combined crystal structure prediction and solid-state 1H NMR spectroscopy – Phys. Chem. Chem. Phys. 15 (2013) 8069-8080 – cover of PCCP and highlighted as HOT PCCP article

  • Luca Mollica, Maria Baias, Jozef R. Lewandowski, Benjamin J. Wylie, Lindsay J. Sperling, Chad M. Rienstra, Lyndon Emsley, Martin Blackledge, Atomic Resolution Structural Dynamics in Crystalline Proteins from NMR and Molecular Simulation – J. Phys. Chem. Lett. 3(23) (2012) 3657-3662

  • Isa Fonseca, Maria Baias, Chris J. Pickard, Sophia Hayes, Marko Bertmer, Effects of aromatic substitution on the photodimerization kinetics of β-trans cinnamic acid derivatives studied with 13C solid-state NMR – J. Phys. Chem. C 116 (2012) 12212-12218

  • N. N. Fathima, M. Baias, B. Bluemich, T. Ramasani, Structure and dynamics of water in native and tanned collagen fibers: effect of crosslinking Int. J. Biol. Macromol. 47 (2010) 590-596

  • M. Baias, D. E. Demco, D. Istrate, C. Popescu, B. Bluemich, M. Moeller, Morphology and molecular mobility of fibrous hard α-keratins by 1H, 13C, and 129Xe NMR – J. Phys. Chem. B 113 (2009) 12136-12147

  • M. Baias, D. E. Demco, B. Bluemich, M. Moeller, State of water in hybrid sulfonated poly(ether ether ketone) – silica membranes by 1H solid-state NMR – Chem. Phys. Lett. 473 (2009) 142-145

  • I. Colicchio, D. E. Demco, M. Baias, H. Keul, M. Moeller, Influence of the silica content in SPEEK-silica membranes prepared from the sol-gel process of polyethoxysiloxane: morphology and proton mobility – J. Membr. Science 337 (2009) 125-135

  • Maria Baias, Dan E. Demco, Crisan Popescu, Radu Fechete, Claudiu Melian, Bernhard Bluemich, Martin Moeller, Thermal denaturation of hydrated wool keratin by 1H solid-state NMR – J. Phys. Chem. B 113 (2009) 2184-2192

  • M. Baias, D. E. Demco, I. Colicchio, B. Bluemich, M. Moeller, Proton exchange in hybrid sulfonated poly(ether ether ketone)-silica membranes by 1H solid-state NMR – Chem. Phys. Lett. 456 (2008) 227-230

  • Adrian Pirnau, Vasile Chis, Ovidiu Oniga, Nicolae Leopold, Laszlo Szabo, Maria Baias, Onuc Cozar, Vibrational and DFT study of 5-3-pyridyl-methylidene-thiazolidine-2-thione-4-one – Vibrational Spectroscopy 48 (2008) 289-296

  • Crisan Popescu, Petre Budrugeac, Franz-Josef Wortmann, Lucretia Miu, Dan E. Demco, Maria Baias, Assessment of collagen-based materials that are supports of cultural and historical objects – Polymer Degradation and Stability 93 (2008) 976-982

  • F. Ruehli, T. Boeni, J. Perlo, F. Casanova, M. Baias, E. Egarter, B. Bluemich, Noninvasive spatial tissue discrimination in ancient mummies and bones by in situ portable nuclear magnetic resonance – Journal of Cultural Heritage 8 (2007) 257-263

  • A. Pirnau, V. Chis, M. Baias, O. Cozar, M. Vasilescu, O. Oniga, S. Simon, Experimental and DFT investigation of 5-para-nitro-benziliden-thiazolidin-2thion-4-ona – J. Optoelectron. Adv. M. 9 (2007) 547-550

  • M. Baias, A. Pirnau, V. Chis, O. Cozar, M. Vasilescu, Experimental and theoretical investigation of 5-para-fluoro-benziliden-thiazolidin-2thion-4-ona – J. Optoelectron. Adv. M. 8 (2006) 205-207

  • Mihai A. Voda, Dan E. Demco, Alexandra Voda, Thomas Schauber, Matthias Adler, Thomas Dabisch, Alina Adams, Maria Baias, Bernhard Bluemich, Morphology of thermoplastic polyurethanes by 1H spin-diffusion NMR. Correlation with thermodynamic and mechanical properties – Macromolecules 39 (2006) 4802-4810

  • Marko Bertmer, Dan E. Demco, Mingfei Wang, Claudiu Melian, Ramona I. Marcean-Chelcea, Radu Fechete, Maria Baias, Bernhard Bluemich, Segmental dynamic heterogeneity of shot-chain grafted-poly(dimethylsiloxane) by 1H spin-diffusion NMR – Chem. Phys. Lett. 431 (2006) 404-409

  • O. Cozar, V. Chis, L. David, M. Baias, Experimental and density functional theory investigation on some biomedical compounds – J. Optoelectron. Adv. M. 8 (2006) 164- 171

Books and Book Chapters

  • Maria Baias, Nuclear Magnetic Resonance (NMR) – The Encyclopedia of Archaeological Sciences (2018), S. L. López Varela (Ed.). – book chapter

  • Maria Baias, Bernhard Bluemich, Nondestructive Testing of Objects from Cultural Heritage with NMR – Modern Magnetic Resonance (2017) 1-13, Springer International Publishing, Ed. Graham A. Webb. – book chapter

  • Maria Baias, Science and history explored by nuclear magnetic resonance, Aachen, Shaker Verlag, 2009. – book

Papers in conference proceedings and other journals

  • J. Orlowsky, M. Raupach, M. Baias, B. Bluemich, Application of the NMR-technique to concrete coatings – Proceedings of the 2nd International Conference on Concrete Repair, Rehabilitation and Retrofitting (ICCRRR), Cape Town, South Africa (2008) 335-336

  • B. Bluemich, A. Adams-Buda, M. Baias, Ageing of polyethylene: Non-destructive testing with mobile magnetic resonance – Gas und Wasserfach Gas Erdgas 148 (2007) 95-98