Editorial Board for section 'Molecular Structure'
- Analytical Chemistry Section
- Applied Chemistry Section
- Bioorganic Chemistry Section
- Chemical Biology Section
- Colorants Section
- Computational and Theoretical Chemistry Section
- Cross-Field Chemistry Section
- Electrochemistry Section
- Flavours and Fragrances Section
- Food Chemistry Section
- Green Chemistry Section
- Inorganic Chemistry Section
- Macromolecular Chemistry Section
- Materials Chemistry Section
- Medicinal Chemistry Section
- Microwave Chemistry Section
- Molecular Liquids Section
- Molecular Structure Section
- Nanochemistry Section
- Natural Products Chemistry Section
- Organic Chemistry Section
- Organometallic Chemistry Section
- Photochemistry Section
- Physical Chemistry Section
- Ultrasound Chemistry Section
Please see the section webpage for more information on this section.
Please note that the order in which the Editors appear on this page is alphabetical, and follows the structure of the editorial board presented on the MDPI website under information for editors: editorial board responsibilities.
Members
Pacific Northwest National Laboratory, School of Engineering & School of Physical Sciences, University of Liverpool, Liverpool L69 3GQ, UK
Interests: atomic resolution and operando scanning transmission electron microscopy studies of energy storage materials and processes; multimodal characterization of new battery systems for a circular economy
Special Issues, Collections and Topics in MDPI journals
Interests: atomic resolution and operando scanning transmission electron microscopy studies of energy storage materials and processes; multimodal characterization of new battery systems for a circular economy
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Faculty of Chemistry, University of Oviedo, 33006 Oviedo, Spain
Interests: crystallography; MOFs; hybrid materials; crystal prediction; synthesis; nanocomposites
Special Issues, Collections and Topics in MDPI journals
Interests: crystallography; MOFs; hybrid materials; crystal prediction; synthesis; nanocomposites
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Department of Physics, Ecole Normale Supérieure Paris Saclay, Paris, France
Interests: molecular and supramolecular engineering for photonic applications; investigation of gold nanostructures for quadratic nonlinear optics; elaboration of waveguiding polymer devices for sensor applications
Special Issues, Collections and Topics in MDPI journals
Interests: molecular and supramolecular engineering for photonic applications; investigation of gold nanostructures for quadratic nonlinear optics; elaboration of waveguiding polymer devices for sensor applications
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Grupo de Espectrocopía Molecular (GEM), Edificio Quifima, Laboratorios de Espectroscopia y Bioespectroscopia, Unidad Asociada CSIC, Parque Científico UVa, Universidad de Valladolid, 47011 Valladolid, Spain
Interests: high-resolution molecular spectroscopy; rotational spectroscopy; structure of biomolecules; interstellar molecules; inter- and intramolecular interactions; laser ablation techniques
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Interests: high-resolution molecular spectroscopy; rotational spectroscopy; structure of biomolecules; interstellar molecules; inter- and intramolecular interactions; laser ablation techniques
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Optics Deparment, Faculty of Physics, Universidad Complutense de Madrid, Plaza de Ciencias 1, 28040 Madrid, Spain
Interests: cryo-electron microscopy; image processing; machine learning; sttructural biology; optics; interferometry
Special Issues, Collections and Topics in MDPI journals
Interests: cryo-electron microscopy; image processing; machine learning; sttructural biology; optics; interferometry
Special Issues, Collections and Topics in MDPI journals
Istituto di Scienze e Tecnologie Chimiche “Giulio Natta” del CNR (SCITEC-CNR), Rome, Italy
Interests: computational algorithms; electronic structure of molecular systems containing heavy elements; framework of the relativistic Dirac-Kohn-Sham method; fundamental aspects of the nature of intermolecular interactions, chemical bonding and excited states; original methods of analysis of the electron density; study the nature of the bond in different molecular systems ranging from interaction in clusters of heavy atoms, the bond in metal catalytic complexes, up to weak intermolecular interactions and hydrogen bonding
Interests: computational algorithms; electronic structure of molecular systems containing heavy elements; framework of the relativistic Dirac-Kohn-Sham method; fundamental aspects of the nature of intermolecular interactions, chemical bonding and excited states; original methods of analysis of the electron density; study the nature of the bond in different molecular systems ranging from interaction in clusters of heavy atoms, the bond in metal catalytic complexes, up to weak intermolecular interactions and hydrogen bonding
Laboratory of Biomolecular Interactions and Transport, Institute of Molecular Biology and Biotechnology, Faculty of Biology, Adam Mickiewicz University and the International Institute of Molecular and Cell Biology in Warsaw, Warsaw, Poland
Interests: molecular dynamics simulations; molecular modeling; molecular docking; virtual screening; computer-aided drug design; protein structure-dynamics-function relationships; structural bioinformatics; effect of mutation; ligand transport; rational protein engineering; computational protein design
Special Issues, Collections and Topics in MDPI journals
Interests: molecular dynamics simulations; molecular modeling; molecular docking; virtual screening; computer-aided drug design; protein structure-dynamics-function relationships; structural bioinformatics; effect of mutation; ligand transport; rational protein engineering; computational protein design
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CICECO-Aveiro Institute of Materials, Department of Physics, University of Aveiro, 3810-193 Aveiro, Portugal
Interests: luminescent materials based on trivalent lanthanide ions; luminescent materials as nanoscale thermal probes; luminescence thermometry; molecular logical gates
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Interests: luminescent materials based on trivalent lanthanide ions; luminescent materials as nanoscale thermal probes; luminescence thermometry; molecular logical gates
Special Issues, Collections and Topics in MDPI journals
Department of Chemical Sciences, ViaCintia, University of Naples Federico II, I-80126 Naples, Italy
Interests: advanced materials: synthesis of molecules and polymers for applications in the fields of liquid-crystals, organic electronics, optoelectronics and photovoltaics; crystal engineering: crystal structures driven by the formation of H bonds, acentric and polar crystals, polymorphism and topotactic transitions, mechanically responsive dynamic crystals, solid-state separation of tautomers
Special Issues, Collections and Topics in MDPI journals
Interests: advanced materials: synthesis of molecules and polymers for applications in the fields of liquid-crystals, organic electronics, optoelectronics and photovoltaics; crystal engineering: crystal structures driven by the formation of H bonds, acentric and polar crystals, polymorphism and topotactic transitions, mechanically responsive dynamic crystals, solid-state separation of tautomers
Special Issues, Collections and Topics in MDPI journals
School of Chemistry, University of Birmingham, Edgbaston, Birmingham B15
2TT, UK
Interests: supramolecular chemistry; crystal engineering; chemical nanoscience; molecular organisation from solid-state and solution-based self-assembly of nanoscale molecular architectures to success in surface molecular organisation
Special Issues, Collections and Topics in MDPI journals
Interests: supramolecular chemistry; crystal engineering; chemical nanoscience; molecular organisation from solid-state and solution-based self-assembly of nanoscale molecular architectures to success in surface molecular organisation
Special Issues, Collections and Topics in MDPI journals
Department of Chemistry, University of Firenze, Via della Lastruccia 3, 50019 Sesto Fiorentino, Italy
Interests: chemical physics; theoretical chemistry; computational chemistry;molecular modeling; molecular dynamics and Monte Carlo simulations;quantum chemistry calculations; polarizable force fields; computer-aided drug design; statistical and nonequilibrium thermodynamics;computational spectroscopy
Interests: chemical physics; theoretical chemistry; computational chemistry;molecular modeling; molecular dynamics and Monte Carlo simulations;quantum chemistry calculations; polarizable force fields; computer-aided drug design; statistical and nonequilibrium thermodynamics;computational spectroscopy
Dipartimento di Chimica, Universita degli Studi di Torino, Torino, Italy
Interests: crystalline molecular materials; crystal engineering; structural characterization; solution and solid-state NMR spectroscopy; weak interactions, hydrogen bond; supramolecular chemistry; crystal forms; polymorphism; co-crystals
Interests: crystalline molecular materials; crystal engineering; structural characterization; solution and solid-state NMR spectroscopy; weak interactions, hydrogen bond; supramolecular chemistry; crystal forms; polymorphism; co-crystals
1. Institute for Microelectronics and Microsystems (CNR-IMM), Via Monteroni, University of Salento, 73100 Lecce, Italy
2. Center for Biomolecular Nanotechnologies, Italian Institute of Technology (IIT), Via Barsanti 14, 73010 Arnesano (Lecce), Italy
Interests: density functional theory; kinetic energy functionals; computational plasmonics; nanocrystals; hybrid interfaces
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2. Center for Biomolecular Nanotechnologies, Italian Institute of Technology (IIT), Via Barsanti 14, 73010 Arnesano (Lecce), Italy
Interests: density functional theory; kinetic energy functionals; computational plasmonics; nanocrystals; hybrid interfaces
Special Issues, Collections and Topics in MDPI journals
Faculty of Pharmacy, University of Szeged, Budapest, Hungary
Interests: ligand-based drug disovery and virtual screening; library design; similarity-based focused library selection and in silico target identification
Interests: ligand-based drug disovery and virtual screening; library design; similarity-based focused library selection and in silico target identification
Faculty of Pharmacy, Medical University of Sofia, Sofia, Bulgaria
Interests: drug design; QSAR; molecular docking; molecular dynamics; proteochemometrics
Special Issues, Collections and Topics in MDPI journals
Interests: drug design; QSAR; molecular docking; molecular dynamics; proteochemometrics
Special Issues, Collections and Topics in MDPI journals
Anatomy and Cell Biology, McGill University, Montreal, QC, Canada
Interests: cryo-EM; cilia; cytoskeleton; motor proteins
Special Issues, Collections and Topics in MDPI journals
Interests: cryo-EM; cilia; cytoskeleton; motor proteins
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Department of Chemistry, School of Science, Tokai University, Kanagawa, Japan
Interests: selenium chemistry; protein chemistry
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Interests: selenium chemistry; protein chemistry
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Institute of Low Temperature and Structure Research, Polish Academy of Sciences, P.O. Box 1410, Okólna 2 Str., 50-950 Wrocław, Poland
Interests: metallophthalocyanines; metal-organic frameworks (MOF); hydrogen bonds; organic frameworks (OF); medicinal chemistry; crystallization; structural chemistry; crystallography; crystal engineering; synthesis; catalysis; theoretical chemistry; computational chemistry; coordination chemistry; inorganic biochemistry; bioinorganic chemistry
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Interests: metallophthalocyanines; metal-organic frameworks (MOF); hydrogen bonds; organic frameworks (OF); medicinal chemistry; crystallization; structural chemistry; crystallography; crystal engineering; synthesis; catalysis; theoretical chemistry; computational chemistry; coordination chemistry; inorganic biochemistry; bioinorganic chemistry
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Department of Chemistry and Chemical Engineering, Inha University, 100 Inha-ro, Michuhol-gu, Incheon 22212, Republic of Korea
Interests: computational chemistry; high-energy density material design; computer-aided materials; drug design
Special Issues, Collections and Topics in MDPI journals
Interests: computational chemistry; high-energy density material design; computer-aided materials; drug design
Special Issues, Collections and Topics in MDPI journals
Department of Chemistry, Texas A&M University, College Station, TX, USA
Interests: Infrared and Raman Spectroscopy; potential energy surfaces; laser induced fluorescence; electronic excited state; large-amplitude vibrations
Interests: Infrared and Raman Spectroscopy; potential energy surfaces; laser induced fluorescence; electronic excited state; large-amplitude vibrations
Arbuzov Institute of Organic and Physical Chemistry, FRC Kazan Scientific Center of RAS, 8 Arbuzov str., Kazan 420088, Russia
Interests: solution state structure; DNMR; GIAO DFT; metal complexes; coordination; non-covalent interactions; absolute stereochemistry; tautomerism
Interests: solution state structure; DNMR; GIAO DFT; metal complexes; coordination; non-covalent interactions; absolute stereochemistry; tautomerism
Department of Chemistry, University of Iowa, Iowa City, IA 52242, USA
Interests: supramolecular chemistry; crystal engineering; noncovalent bonding; solid-state reactions; photochemistry
Interests: supramolecular chemistry; crystal engineering; noncovalent bonding; solid-state reactions; photochemistry
PLÉIADES beamline, Synchrotron SOLEIL, L'orme des Merisiers, Saint-Aubin-BP48, 91192 GIF-sur-YVETTE, CEDEX, France
Interests: experimental physics of atoms and molecules; electron and photon interactions with gas-phase biomolecules and nanostructures; X-ray spectroscopy; electron optics, electron-trace simulations; electron transmission through nanocapillaries
Interests: experimental physics of atoms and molecules; electron and photon interactions with gas-phase biomolecules and nanostructures; X-ray spectroscopy; electron optics, electron-trace simulations; electron transmission through nanocapillaries
Department of Industrial Engineering, University of Florence, via S. Marta 3, 50139 Florence, Italy
Interests: single crystal and microcrystalline powder X-ray diffraction; computational chemistry; molecular and crystal structures of organic compounds, API and metal complexes; structure-property relationships; supramolecular chemistry; phase transitions; polymorphism
Special Issues, Collections and Topics in MDPI journals
Interests: single crystal and microcrystalline powder X-ray diffraction; computational chemistry; molecular and crystal structures of organic compounds, API and metal complexes; structure-property relationships; supramolecular chemistry; phase transitions; polymorphism
Special Issues, Collections and Topics in MDPI journals
Department of Chemistry, Clemson University, Clemson, SC, USA
Interests: Halogen bonding; crystal chemistry
Interests: Halogen bonding; crystal chemistry
Department of Pharmacy, University of Naples Federico II, 80131 Naples, Italy
Interests: metabolomics studies; multi-omics studies; drug–DNA interaction
Special Issues, Collections and Topics in MDPI journals
Interests: metabolomics studies; multi-omics studies; drug–DNA interaction
Special Issues, Collections and Topics in MDPI journals
Environmental Health Sciences (EHS), University of Michigan, Ann Arbor, MI 48109, USA
Interests: computational molecular modeling with applications to drug discovery; mechanisms of neurodegenerative diseases; neurotoxicology
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Interests: computational molecular modeling with applications to drug discovery; mechanisms of neurodegenerative diseases; neurotoxicology
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Institute of Physical and Theoretical Chemistry, University of Bonn, Bonn, Germany
Interests: EPR; pulsed dipolar spectroscopy; oligonucleotides; proteins; spinlabels
Special Issues, Collections and Topics in MDPI journals
Interests: EPR; pulsed dipolar spectroscopy; oligonucleotides; proteins; spinlabels
Special Issues, Collections and Topics in MDPI journals
Department of Chemical Engineering, Texas A&M University, College Station, TX 77843, USA
Interests: lithium-based batteries; materials for electrodes and electrolytes; research on rechargeable batteries for electric vehicles; molecular devices and systems using molecular potentials and molecular vibrations for processing and transport of information at nanometer scales
Interests: lithium-based batteries; materials for electrodes and electrolytes; research on rechargeable batteries for electric vehicles; molecular devices and systems using molecular potentials and molecular vibrations for processing and transport of information at nanometer scales
Department of Chemistry, Wright State University, Dayton, OH 45435, USA
Interests: applied quantum chemistry; chemical properties; spectroscopy; molecular structure-property relations; computational chemistry; energy transfer; complex systems, agent based (cellular automata) models of complex systems
Interests: applied quantum chemistry; chemical properties; spectroscopy; molecular structure-property relations; computational chemistry; energy transfer; complex systems, agent based (cellular automata) models of complex systems
