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Gregory DoerkView profile

Researcher

• Self-assembly
• Block copolymers
• Nanofabrication
• +5 more

Gregory Doerk is a Materials Scientist specializing in AI Accelerated Nanoscience at Brookhaven National Laboratory's Center for Functional Nanomaterials (CFN). As a key member of the Electronic Nanomaterials Group, he conducts cutting-edge research on self-assembly processes for nanofabrication applications. His work bridges fundamental polymer science with practical applications in energy, optics, and electronics manufacturing. Doerk earned his B.S. in Chemical Engineering from Case Western Reserve University (2005) and his Ph.D. in Chemical Engineering from the University of California, Berkeley (2010). His academic journey was complemented by philosophical studies that shaped his approach to scientific inquiry, recognizing both the power and limitations of scientific knowledge. Dr. Doerk's research focuses on directing the self-assembly of polymers to create tailored nano-architectures for optical, chemical, and energy applications. He specializes in block copolymer systems, developing combinatorial, high-throughput, and adaptive experimental methods to integrate self-assembly into scalable manufacturing processes. His work addresses the challenge of scaling block copolymer assembly to larger feature sizes (approaching 200nm) that can influence light for structural color applications, overcoming the natural limitations of traditional block copolymer systems. His 15 most recent publications reveal a strong trajectory toward AI-accelerated materials discovery, with increasing focus on autonomous experimentation, combinatorial approaches, and hierarchical structures. The research spans fundamental polymer science to applied nanotechnology, with applications in photonic materials, energy conversion, and advanced manufacturing. His work demonstrates a progression from basic self-assembly mechanisms to increasingly sophisticated systems incorporating machine learning and high-throughput methodologies. 2021 DOE Early Career Research Program award recipient As a senior scientist at CFN, Doerk mentors numerous users from academic and industrial institutions worldwide, helping them develop self-assembly processes for diverse applications ranging from microfluidics to biosensing. He has secured significant research funding, including the prestigious DOE Early Career award, and actively contributes to the scientific community through organizing workshops at major conferences including the American Physical Society March Meeting and the NSLS-II & CFN User Meetings. His collaborative approach has resulted in numerous interdisciplinary projects spanning multiple DOE facilities. Dr. Doerk leads research in the Electronic Nanomaterials group at CFN, where he operates specialized equipment for block copolymer self-assembly, solvent vapor annealing, and pattern transfer. His lab focuses on developing adaptive experimental methods that combine self-assembly with AI-driven discovery, creating a unique environment where traditional materials science intersects with cutting-edge computational approaches. The team regularly collaborates with researchers using Brookhaven's National Synchrotron Light Source II for in-situ characterization of self-assembly processes.

Feng WangView profile

Professor

• Theoretical and Computational Chemistry
• Molecular Spectroscopy
• Sustainable Aviation Fuels
• +7 more

Professor Feng Wang is a leading academic in theoretical and computational chemistry at the Department of Chemistry and Biotechnology, School of Science, Computing and Emerging Technologies, Swinburne University of Technology, Melbourne, Australia. She holds a PhD from the University of Newcastle and has held research positions at the University of Waterloo, University of Melbourne, and Swinburne. Education: PhD, The University of Newcastle, Australia MSc (Quantum Chemistry by Research), Sichuan University, China BSc (Physical Chemistry), Sichuan University, China Prof Cert (Teaching Practice, Higher Education), Swinburne University of Technology, Australia Her research spans molecular spectroscopy, sustainable aviation fuels, corrosion science, and computational drug design, with applications in energy, environment, and pharmaceuticals. She employs advanced methods like density functional theory (DFT), molecular dynamics, and machine learning to study molecular systems and materials. Her recent publications (2024–2025) reflect a strong focus on sustainable energy materials—particularly high-energy-density aviation fuels (e.g., JP-10, norbornyl derivatives), CO2 conversion, and battery aging—alongside computational drug discovery for SARS-CoV-2 and flavonoid-based antivirals. These works integrate quantum mechanics, NMR analysis, and AI-driven modeling. Scientific Awards and Honors: Fellow, Royal Australian Chemical Institute (RACI) Fellow, Australian Institute of Physics (AIP) Vice-Chancellor's Research Award, Swinburne University of Technology Professor Wang actively mentors PhD and Master’s students and leads nationally funded research projects. She serves on the Australian Research Council (ARC) College of Experts and has chaired the National Computational Merit Allocation Scheme (NCMAS). She evaluates proposals for international agencies including FRQNT (Canada), SFI (Ireland), FCT (Portugal), and SNSF (Switzerland). Her lab, the Digital Chemistry Research Laboratory, contributes to UN Sustainable Development Goals 7 and 13.

Zachary J. TonzetichView profile

Associate Professor

• Bioinorganic chemistry
• Catalysis
• Kinetics and mechanism of inorganic reactions
• +4 more

Zachary J. Tonzetich is an Associate Professor and Graduate Advisor of Record for the PhD program in the Department of Chemistry at the University of Texas at San Antonio (UTSA), where he leads the Tonzetich Research Group within the College of Sciences. His laboratory focuses on synthetic inorganic and organometallic chemistry, with emphasis on Earth-abundant metal catalysis, bioinorganic chemistry, and coordination chemistry. Dr. Tonzetich received his educational training at prestigious institutions: Ph.D. in Inorganic Chemistry from Massachusetts Institute of Technology B.S. in Chemistry from University of Rochester Dr. Tonzetich's research spans three primary areas: Earth-abundant metal catalysis, bioinorganic chemistry, and coordination chemistry. His work in Earth-abundant metal catalysis focuses on understanding the mechanisms of non-precious metal catalysts through synthesis of new organometallic complexes, particularly with iron. In bioinorganic chemistry, he investigates transition-metal compounds containing biologically relevant small molecules like NO and H 2 S. His coordination chemistry research explores new pincer ligands based on pyrrole moieties as alternatives to traditional pyridine-based ligands. An analysis of Dr. Tonzetich's recent publications (2020-2024) reveals a strong focus on iron and cobalt chemistry, particularly with pincer ligands and imido/silyl complexes. His work demonstrates expertise in mechanistic studies of catalytic reactions including hydrosilylation, hydroboration, and nitrene transfer. The publications span high-impact journals across inorganic, organometallic, and catalytic chemistry, reflecting the interdisciplinary nature of his research program. Dr. Tonzetich actively mentors students at all levels, supervising multiple doctoral, master's, and undergraduate researchers in his laboratory. His group has participated in the ACS Project SEED program every summer since 2011, mentoring five different San Antonio area students. He also serves as a judge for science fairs including the Texas Science & Engineering Fair and the Alamo Regional Academy of Science and Engineering Fair. The Tonzetich Research Group operates out of the Biotechnology, Sciences and Engineering Building (BSE) at UTSA, with laboratory space featuring modern equipment including Vacuum Atmospheres gloveboxes, Schlenk lines, solvent purification systems, UV-vis spectrophotometer, electrochemical workstation, and IR spectrometer. The group maintains an active research program with numerous publications and collaborations.

D. Brandon MagersView profile

Professor

• Computational Chemistry
• Electronic Structure Theory
• Chemistry Education
• +2 more

Dr. D. Brandon Magers is a Professor and Chair of Chemistry and Physics at Belhaven University , where he has been part of the faculty since 2019. He also serves as a Faculty Fellow of Instructional Technology since 2022, supporting colleagues in integrating educational technology into teaching. Education: B.S., Mississippi College Ph.D., University of Georgia Dr. Magers’ research and teaching interests span Computational Chemistry , Electronic Structure Theory , Chemistry Education , and Physical Chemistry . His work combines theoretical studies of molecular systems with innovative educational approaches to enhance laboratory and programming instruction. His recent publications highlight two main themes: theoretical chemistry (e.g., reaction kinetics, ion binding, and molecular modeling) and chemistry education (e.g., development of open-source tools, data processing in labs). Earlier contributions include foundational studies on strain energy and radical structure using computational methods. Dr. Magers actively mentors undergraduate researchers, guiding presentations at local, regional, and national levels. He also contributes to professional communities as an officer for the Mississippi Local Section of the American Chemical Society .

• Molecular electronics
• Nanoelectronics
• Quantum computing
• +8 more

Mariagrazia Graziano is an Associate Professor at the Department of Applied Science and Technology (DISAT) at Politecnico di Torino, where she also serves as Director of the Teaching and Language Lab (TLLab). Her academic career spans multiple institutions, including her involvement with doctoral colleges at the University of Palermo for 'Technologies and Methods for University Education' from 2022-2025. Her research interests are at the forefront of nanotechnology and quantum computing, focusing on areas including: Molecular field-coupled nanocomputing Logic-in-memory computing architectures Quantum hardware design and optimization Single-molecule devices for logic and memory applications Nanomagnetism and spintronics Micro-for-Nano (M4N) Systems for Single Molecule Sensors Dr. Graziano's work bridges fundamental physics with practical applications in electronics, with particular emphasis on next-generation computing paradigms that address the memory-wall problem and explore alternatives to traditional von Neumann architectures. Her research has significant implications for fields ranging from molecular electronics to quantum information processing. Her recent publications demonstrate a strong focus on molecular field-coupled nanocomputing, quantum optimization techniques, and single-molecule device modeling. These works reveal a consistent research trajectory toward developing novel computing architectures that leverage quantum effects and molecular-scale phenomena to overcome limitations of conventional semiconductor technology. Dr. Graziano has received notable recognition including the prestigious Marie Curie Intra-European Fellowship for Career Development from the European Commission (2014). She serves as Associate Editor for FRONTIERS IN ELECTRONICS (since 2022) and JOURNAL OF COMPUTATIONAL ELECTRONICS (since 2019), and has participated in program committees for major conferences including the IEEE Design Automation and Test Conference Europe. As an advisor, Dr. Graziano mentors numerous PhD students working on cutting-edge research in quantum computing, molecular electronics, and nanotechnology. Her supervision spans multiple doctoral programs at Politecnico di Torino, with students exploring topics from quantum algorithms for urban traffic optimization to single-molecule junctions for next-generation electronics. Additionally, she leads several research projects including TENS (Toward Excellence in Nanocharacterisation of single-molecule Sensors) and previously served as Scientific Leader for the Quantum Computing e Quantum Networking project. Dr. Graziano is actively involved in the VLSILAB research group, where she contributes to advancing the state-of-the-art in electronic design and nanoscale computing technologies. Her work on patents, particularly the 'Device for Realizing Boolean Logic Functions XOR XNOR Inside Racetrack Memory,' demonstrates her commitment to translating theoretical research into practical technological innovations.

• Microbiology
• Actinomycetes
• Atacama Desert Microbiology
• +6 more

Dr. Barbara Andrews is a researcher in the Department of Chemical Engineering at the Faculty of Chemical and Pharmaceutical Sciences, Universidad de Chile. Her work focuses on the microbiology of extreme environments, particularly the Atacama Desert, and biochemical separation techniques. She has maintained a consistent research output for over two decades with recent publications extending into 2024. Her primary research interests center on the study of actinomycetes and other extremophiles from the Atacama Desert, one of Earth's most arid environments. Dr. Andrews investigates their taxonomic classification, metabolic capabilities, and biotechnological potential. She also maintains a strong research program in protein separation technologies, particularly aqueous two-phase systems, which has produced influential review articles in the field. Her work bridges fundamental microbiology with practical biotechnological applications, including antibiotic discovery, enzyme production, and microbial contributions to plant growth. Analysis of her recent publication trends shows a clear focus on the microbial ecology of the Atacama Desert, with particular attention to actinomycetes and their unique adaptations to extreme aridity. Her research spans taxonomic studies, metabolic modeling, and the bioprospecting of novel compounds with potential pharmaceutical applications. The interdisciplinary nature of her work connects microbiology, chemical engineering, and environmental science. Dr. Andrews has maintained a productive research program through consistent collaborations, particularly with Dr. Juan Asenjo and other researchers at Universidad de Chile. Her work demonstrates sustained funding support, though specific grant details are not provided in the available publications. She has contributed to special journal issues focused on Atacama Desert microbiology, indicating her recognized expertise in this niche field. Her laboratory appears to focus on the isolation and characterization of extremophilic microorganisms from the Atacama Desert, with particular emphasis on their metabolic capabilities and potential biotechnological applications. The research team likely maintains culture collections of desert microorganisms and employs both traditional microbiological techniques and modern genomic approaches in their investigations.

Veena SahajwallaView profile

Professor

• Recycling Science
• Materials Engineering
• Sustainable Materials
• +7 more

Scientia Professor Veena Sahajwalla is an ARC Laureate Professor and founding Director of the Centre for Sustainable Materials Research & Technology (SMaRT) at the University of New South Wales. She also heads the ARC Industrial Transformation Research Hub for 'green manufacturing' and serves as Director of the NSW Circular Economy Innovation Network. Professor Sahajwalla is internationally recognized for revolutionizing recycling science through her pioneering work in high-temperature transformation of waste into 'green materials.' Professor Sahajwalla's research focuses on sustainable materials engineering, waste transformation, and circular economy implementation. Her work spans materials engineering, metallurgy, polymer science, and environmental technologies. She has developed groundbreaking approaches to recycling complex waste streams including e-waste, plastics, and automotive waste, transforming them into value-added materials for manufacturing applications. Her research integrates fundamental scientific understanding with practical industrial applications to create economically viable and environmentally sustainable solutions. Professor Sahajwalla's publications demonstrate consistent innovation in waste-to-resource conversion technologies, particularly in microrecycling approaches and high-temperature material transformation. Her work shows a clear progression from fundamental research to practical implementation through her microfactory model, which brings recycling solutions directly to waste sources. The research spans multiple disciplines including materials science, metallurgy, polymer engineering, and environmental technology, with increasing focus on decentralized manufacturing systems and circular economy implementation. Fellow of the Australian Academy of Science (2018) PLuS Alliance Prize for Research Innovation (2017) Jubilee Professorship by Indian Academy of Sciences (2017) Australia's Most Innovative Engineers (2016) Australia's 100 Most Influential Engineers (2015) ARC Laureate Fellowship (2014) Howe Memorial Lecture Award (2013) Australian Innovation Challenge Winner for Green Steel (2012) Professor Sahajwalla has secured over $40 million in research funding from diverse sources including the Australian Research Council, NSW Government, and industry partners. Her leadership extends to mentoring programs for girls in science (Science 50:50) and extensive public engagement through media appearances, TED talks, and community outreach. She has established the world's first e-waste microfactory (2018) and plastics microfactory (2019), demonstrating practical applications of her research. As founding Director of the SMaRT Centre at UNSW, Professor Sahajwalla leads a multidisciplinary team focused on sustainable materials research and technology development. The Centre collaborates with industry partners, government agencies, and international research institutions to translate scientific discoveries into real-world environmental and economic benefits through the microfactory model and other innovative approaches to waste valorization.

• Machine Learning
• Quantum Chemistry
• Computational Chemistry
• +3 more

Pavlo O. Dral serves as Associate Professor at Xiamen University's Department of Chemistry, College of Chemistry and Chemical Engineering since 2019, following postdoctoral research at the Max-Planck-Institut für Kohlenforschung. His academic credentials include: BS (2004-2008), National Technical University of Ukraine M.Sc. (2008-2010), University of Erlangen-Nürnberg Mag. (2008-2010), National Technical University of Ukraine Dr. (2010-2013), University of Erlangen-Nürnberg Dr. Dral's research pioneers the integration of Machine Learning with Quantum Chemistry , focusing on developing the MLatom package for atomistic simulations, creating accurate NDDO-based semiempirical methods, and designing hybrid computational approaches. His work targets efficient solutions for complex physicochemical problems through innovative algorithm development. Analysis of his 15 publications (2014-2020) reveals consistent advancement in machine learning applications across quantum chemistry domains, including potential energy surface modeling, excited-state dynamics, and molecular property prediction. Key thematic trends involve hierarchical learning architectures, big data integration for quantum approximations, and methodological innovations in organic semiconductor characterization. Information regarding scientific awards, student advising, research grants, and laboratory teams is not provided in the source documentation.

Joseph W. RachlinView profile

Professor

• Fish Ecology
• Population Dynamics
• Niche Overlap
• +6 more

Dr. Joseph W. Rachlin serves as Professor of Biological Sciences at Lehman College, City University of New York (CUNY), and holds a concurrent professorship in the Biology Ph.D. Program at the CUNY Graduate School and University Center. He directs Lehman College's Laboratory for Marine and Estuarine Research (LaMER) and serves on the Advisory Board for the National Institutes of Health's Minority Access to Research Careers Programs at Lehman College. Dr. Rachlin's educational background includes: B.S. in Biology, 1957, City College of New York M.S. in Biology, 1962, New York University Ph.D. in Biology, 1967, New York University His research spans Fish Ecology (population dynamics, niche overlap), Fish Systematics (phylogeny, cytogenetics), and broader Aquatic and Estuarine Ecology, with specialized focus on archaeological sub-fossils from Pakistan's Ghazi Shah site. LaMER employs cytogenetics for evolutionary studies, mathematical modeling for population dynamics, and computational approaches for resource partitioning analysis in aquatic environments. Analysis of Dr. Rachlin's publications (1977-2011) reveals persistent investigation of urban aquatic ecosystems (notably the Bronx River), marine species interactions, and cytogenetic relationships. His work integrates field ecology with computational methods, evolving from foundational sturgeon diet studies to contemporary analyses of invasive species and urban stream resilience. Scientific recognition includes: Fellow of The Linnean Society of London (with transcription of the historic 1858 Darwin/Wallace paper) Dr. Rachlin contributes to national research standards through the American Fisheries Society's Guidelines for the Use of Fishes in Research (2004) and mentors underrepresented scholars via NIH programs. His laboratory continues developing high-end computer graphics for virtual morphological modeling of aquatic organisms, advancing form-function analysis in comparative biology. LaMER (Rooms 231-A & 231-B, Davis Hall) maintains active research programs in phylogenetic relationships, life history strategies, and anthropogenic impacts on marine and estuarine species, supporting both undergraduate and graduate student research.

• Scientific Computing
• Numerical Analysis
• Numerical Methods for PDE
• +4 more

Professor Talal Rahman is a faculty member at the Western Norway University of Applied Sciences, where he works in the Department of Computer Science, Electrical Engineering and Mathematical Sciences. His office is located at Bergen KRONSTAD D305, and he can be reached at phone number +47 55 58 72 46. Professor Rahman's research spans several key areas in computational mathematics and scientific computing. His primary research interests include: Scientific Computing Numerical Analysis Numerical Methods for Partial Differential Equations Preconditioning Finite Element with Domain Decomposition Methods Variational Image Processing Artificial Intelligence and Machine Learning applications Professor Rahman's extensive publication record demonstrates a strong focus on domain decomposition methods, particularly Schwarz methods and their applications to multiscale problems. His recent work shows an increasing integration of machine learning techniques with traditional numerical methods, as evidenced by publications on neural network applications for environmental modeling and capelin migration patterns. His research also extends to biomedical applications, including computational analysis of biodegradable materials and bone tissue engineering scaffolds. He has made significant contributions to the development of adaptive preconditioners and parallel algorithms for solving complex numerical problems, with his work on the TV-Stokes model for image processing representing an important contribution to the field of variational image processing. Professor Rahman has supervised numerous research projects and students, though specific student names are not provided in the available information. His research appears to be supported by grants related to computational science and engineering, though specific grant details are not mentioned in the provided text. Based on his research areas, Professor Rahman likely collaborates with various research groups focused on computational science, with potential connections to biomedical engineering labs and environmental research teams studying the Barents Sea ecosystem.

Jin W. ChoiView profile

Professor

• BioMEMS
• Biosensors
• Bioelectronic Devices
• +5 more

Jin W. Choi is Professor of Electrical and Computer Engineering at Michigan Technological University's College of Engineering, having previously held the Mark and Carolyn Guidry Professorship at Louisiana State University where he served as ABET coordinator and graduate program advisor. Education: PhD, Electrical and Computer Engineering, University of Cincinnati MS, Electrical Engineering, Seoul National University BS, Electrical Engineering, Seoul National University His research centers on BioMEMS , Biosensors , Microfluidics , and Flexible Electronics for biomedical applications. Notable achievements include a 2020 US patent for a wireless implantable neural stimulator to improve quality of life in neurodegenerative disease patients and leadership of the BioMEMS and Bioelectronics Laboratory. Recent publications demonstrate expertise in PCB-based electrochemical sensors, portable fluorescence systems, and impedimetric probes with applications spanning cryobiology, environmental monitoring, and healthcare diagnostics. Scientific recognition includes: US Patent for wireless implantable neural stimulator (2020) Editor of Micro and Nano Engineering (Elsevier) Dr. Choi mentors graduate students in micro/nanofabrication and sensor development while teaching specialized courses including Chemical and Biological Sensors and BioMEMS, with research projects focused on biomedical IoT sensor systems and biomolecular devices.

Richard A. YoungView profile

Professor

• Gene Expression Regulation
• Transcriptional Regulatory Circuitry
• Biomolecular Condensates
• +5 more

Richard A. Young is a Professor of Biology at the Massachusetts Institute of Technology and a Member of the Whitehead Institute where he has been since 1984. His laboratory studies the regulation of gene expression in health and disease, with particular focus on transcriptional regulatory circuitry and biomolecular condensates that control cell identity and function. His work bridges fundamental molecular mechanisms with therapeutic applications in cancer and other diseases. Young received his PhD from Yale University in 1975. His research has fundamentally transformed our understanding of gene regulation, particularly through the discovery of super-enhancers and the role of biomolecular condensates in transcriptional control. His work has revealed how defects in these regulatory mechanisms contribute to cancer, neurodevelopmental disorders, and chronic diseases. Young's laboratory investigates several interconnected research areas including transcriptional regulatory circuitry that controls gene expression programs specifying different cell types, the protein and RNA machinery controlling gene expression during development, and the role of biomolecular condensates in gene regulation. His team discovered that gene regulation occurs within non-membrane-bound organelles called biomolecular condensates, which has changed our understanding of cellular organization and led to new therapeutic concepts for disease treatment. His research publications reveal a consistent trajectory focusing on gene regulation mechanisms, with recent work emphasizing the role of biomolecular condensates in health and disease. His laboratory has made significant contributions to understanding how transcription factors, RNA, and chromosomal architecture work together to control gene expression, with implications for cancer therapeutics, chronic disease mechanisms, and protein compartmentalization. Developed technology to map human genome regulatory circuitry Discovered core regulatory circuitry of human embryonic stem cells Recognized among top 50 leaders in science, technology and business by Scientific American (2006) Elected member of the National Academy of Sciences (2012) Elected member of the National Academy of Medicine (2019) Burroughs Wellcome Scholarship Chiron Corporation Biotechnology Research Award Yale's Wilbur Cross Medal Young has mentored numerous postdoctoral fellows and graduate students who have gone on to successful careers in academia and industry. His laboratory receives substantial funding for research on gene regulation mechanisms and their implications for disease. The lab maintains valuable collaborations with scientists across multiple disciplines including basic biology, chemistry, physics, computing, and medicine, with physician-scientists representing multiple clinical specialties who contribute to the lab's mission of translating basic science discoveries into patient care advancements. The Young laboratory consists of scientists with diverse backgrounds in basic biology, chemistry, physics, computing, and medicine. The team includes physician-scientists who conduct clinical care in Boston's major hospitals while contributing to the lab's research mission. The laboratory maintains extensive collaborations with other talented scientists across multiple institutions and has developed important technologies for mapping regulatory circuitry and understanding biomolecular condensates in cellular function.

Tjerk P. StraatsmaView profile

Adjunct Professor

• Computational Chemistry
• Biomolecular Simulation
• High Performance Computing
• +3 more

Dr. Tjerk P. Straatsma serves as an Adjunct Professor in the Department of Chemistry at the University of Alabama and holds the position of Distinguished Research Scientist at Oak Ridge National Laboratory (ORNL). At ORNL, he manages the Scientific Computing group within the National Center for Computational Sciences, which operates the Oak Ridge Leadership Computing Facility—the home of the United States' most powerful supercomputer for open science. His research expertise lies in computational chemistry and high-performance computing, with a focus on developing advanced simulation methods for chemical and biomolecular systems. Dr. Straatsma has pioneered techniques for atomic-level modeling of microbial membrane processes, material transport, and complex enzymatic reactions involving electron and proton transfers. His work bridges theoretical chemistry, computer science, and applications in geochemistry and biochemistry. Recent publications highlight his leadership in non-orthogonal configuration interaction methods and fragment-based approaches for quantum chemistry, particularly applied to singlet fission phenomena and electronic coupling calculations. These studies leverage cutting-edge high-performance computing architectures to address challenges in energy conversion and materials science. Dr. Straatsma collaborates extensively with Prof. David A. Dixon on projects including an Energy Frontiers Research Center investigating acid gas absorption in metal-organic frameworks and an INCITE project dedicated to actinide chemistry. He has directed the development of the NWChem computational chemistry software suite and currently oversees scientific computing initiatives at ORNL that support thousands of researchers nationwide.

Andrea CappelliView profile

Professor

• Pharmaceutical Chemistry
• Medicinal Chemistry
• Organic Synthesis
• +6 more

Andrea Cappelli is a Full Professor at the Department of Biotechnology, Chemistry and Pharmacy within the University of Siena . He teaches courses in Technology, Socio-economics, and Pharmaceutical Law as part of the 4-year Pharmaceutical Chemistry and Technology program. His research focuses on pharmaceutical chemistry , medicinal chemistry , and biochemistry , with a particular emphasis on organic synthesis , photochemistry , and drug delivery systems . Recent publications highlight his work in synthesis of dual enzyme inhibitors , lysine-targeted covalent ligands , and light-responsive molecular switches . His studies often involve photophysical analysis , macrocyclic compound development , and biomimetic material design . Andrea Cappelli is actively engaged in molecular modeling and structure-activity relationship investigations for therapeutic applications.

Claudia MugnainiView profile

Associate Professor

• Medicinal Chemistry
• Pharmaceutical Chemistry
• Heterocyclic Compounds
• +8 more

Claudia Mugnaini is an Associate Professor in the Department of Biotechnology, Chemistry and Pharmacy at the University of Siena. Her research focuses on the design and synthesis of small heterocyclic molecules for pharmacological applications, with key areas including selective CB2 receptor ligands, GABA B receptor modulators, antibiotic adjuvants for EXCAPE pathogens, and multi-target-directed ligands for neurodegenerative disorders. Recent research trends highlight her work in: Photoresponsive dual-action compounds for Alzheimer's therapy TRPV1 agonists for neurological targets CB2 receptor/cholinesterase hybrid molecules Structure-activity relationship optimization In vitro and in vivo neuroprotective models Allosteric modulation of GABA B receptors Current teaching activities include Medicinal and Toxicological Chemistry modules in the 5-year Pharmaceutical Chemistry program. She maintains active laboratory research in Lab 10128, with recent publications in Molecules and European Journal of Pharmaceutical Sciences .