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Molecules publishes Special Issues to create collections of papers on specific topics, with the aim of building a community of authors and readers to discuss the latest research and develop new ideas and research directions. Special Issues are led by Guest Editors, who are experts on the topic and all Special Issue submissions follow MDPI's standard editorial process. The journal’s Editor-in-Chief and/or designated Editorial Board Member will oversee Guest Editor appointments and Special Issue proposals, checking their content for relevance and ensuring the suitability of the material for the journal. The papers published in a Special Issue will be collected and displayed on a dedicated page of the journal’s website. Further information on MDPI's Special Issue policies and Guest Editor responsibilities can be found here. For any inquiries related to a Special Issue, please contact the Editorial Office.

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Flame-Retardant Composites: Preparation, Characterization and Properties
edited by Zunbin Duan and Rui Li
submission deadline 30 Apr 2027 | 1 articles | Viewed by 397 | Submission Open
Keywords: flame-retardant molecules; flame-retardant composites; nanomaterials; fire safety technology; polymer engineering
(This special issue belongs to the Section Materials Chemistry)
Sustainable Chemistry with Organophosphorus Compounds
edited by
submission deadline 30 Apr 2027 | Viewed by 391 | Submission Open
Keywords: organophosphorus compounds; phosphonates; phosphinates; phosphazenes; bisphosphonates; sustainable chemistry
(This special issue belongs to the Section Green Chemistry)
Functional Polymeric Materials for Molecular Recognition and Bioseparation
edited by
submission deadline 30 Apr 2027 | Viewed by 390 | Submission Open
Keywords: functional polymeric materials; molecularly imprinted polymers; smart/responsive polymers; biomimetic interfaces; affinity polymers; surface-imprinted materials; hydrogels; membranes; bioseparation; affinity chromatography; membrane separation; integrated system; continuous bioprocessing
(This special issue belongs to the Section Macromolecular Chemistry)
Synthesis and Application of Nanomaterials for Bio-Based and Environmental Pollution Molecules Detection and Purification
edited by and Gina M. Chiarella
submission deadline 30 Apr 2027 | Viewed by 351 | Submission Open
Keywords: nano-enabled environmental cleanup; sustainable nanotechnology; toxic ion sequestration; environmental remediation; nano compound synthesis; green, eco-friendly nanomaterials as catalysis; water, food, and soil safety
(This special issue belongs to the Section Nanochemistry)
Fungal Biotechnology: Discovery, Biosynthesis, and Translation
edited by and Shoji Maehara
submission deadline 30 Apr 2027 | 1 articles | Viewed by 344 | Submission Open
Keywords: fungal metabolites; fungal natural products; secondary metabolites; bioactive compounds; endophytic fungi; host–fungus interactions; purification; structure elucidation; LC–MS/MS; spectroscopy; dereplication; biosynthetic pathways (chemical perspective); biocatalysis; semisynthesis; plant growth promotion; bioprocessing; biocontrol agents; biomaterials
(This special issue belongs to the Section Natural Products Chemistry)
Molecular Insights into Polyoxometalate-Based Functional Materials
edited by Florence Volatron
submission deadline 30 Apr 2027 | Viewed by 338 | Submission Open
Keywords: POM-based materials; nanoobjects; thin films; multidimensional networks; composites; soft matter; nanoscale microscopies; X-ray spectroscopies; X-ray diffraction
(This special issue belongs to the Section Inorganic Chemistry)
Preparation, Characterization and Application of Activated Carbons submission deadline 30 Apr 2027 | Viewed by 334 | Submission Open
Keywords: activated carbons; carbon materials; adsorption; absorption; adsorbents; porous materials; biomass-derived porous materials; catalysts; modeling
(This special issue belongs to the Section Materials Chemistry)
Nature-Inspired Drug Discovery
edited by
submission deadline 30 Apr 2027 | Viewed by 327 | Submission Open
Keywords: nature-inspired drug discovery; natural products; bioinspired medicinal chemistry; biomimetic synthesis; natural product-inspired scaffolds; semi-synthetic compounds; chemical biology; structure–activity relationships (SARs); molecular recognition; marine natural products; plant- and microbial-derived scaffolds; nucleic acid-targeting ligands; enzyme and receptor modulation; computational drug design
(This special issue belongs to the Section Natural Products Chemistry)
Advances in Targeted Delivery of Nanomedicines, 2nd Edition submission deadline 30 Apr 2027 | Viewed by 308 | Submission Open
Keywords: nanomedicines; drug delivery; target delivery; nanoscience; cancer signaling
(This special issue belongs to the Section Medicinal Chemistry)
Applied Chemistry in Asia, 2nd Edition
edited by Lihua Wang and
submission deadline 30 Apr 2027 | Viewed by 287 | Submission Open
Keywords: applied chemistry; new molecules and natural materials; solar energy and photo-electro-catalysis; analytical methods and techniques; electrochemistry and energy; biodegradable materials and medicines; environment and green chemistry
(This special issue belongs to the Section Applied Chemistry)
Review Papers in Inorganic Chemistry
edited by
submission deadline 30 Apr 2027 | Viewed by 281 | Submission Open
Keywords: coordinative compounds; metallodrug; biological activity; target biomolecule; essential ion; carrier
(This special issue belongs to the Section Inorganic Chemistry)
Innovative Directions in the Development of Functional Food
edited by , and Danuta Kołożyn-Krajewska
submission deadline 30 Apr 2027 | 1 articles | Viewed by 276 | Submission Open
Keywords: food fermentation; functional food; nutritional value of food; probiotics; prebiotics; texture of food; antioxidant activity; chemical composition
(This special issue belongs to the Section Food Chemistry)
Molecular Mechanisms of Rhizosphere Microbe–Plant Interactions: Chemical Signaling, Metabolite Exchange and Synergistic Networks
edited by
submission deadline 30 Apr 2027 | 1 articles | Viewed by 256 | Submission Open
Keywords: rhizosphere microbiome; plant–microbe interaction; stress resilience; nutrient supply; sustainable agriculture
(This special issue belongs to the Section Natural Products Chemistry)
Magnetic Composite: Structures, Properties, and Potential Applications
edited by
submission deadline 30 Apr 2027 | Viewed by 250 | Submission Open
Keywords: magnetic composites; multifunctional materials; structure–property relationships; interface engineering; hybrid and nanostructured composites; electromagnetic and sensing applications; energy harvest; advanced functional materials; magnetoelectric materials
(This special issue belongs to the Section Materials Chemistry)
Design, Mechanism, and Applications of Photoinduced/Photocatalyzed Multicomponent Reactions
edited by and
submission deadline 30 Apr 2027 | Viewed by 248 | Submission Open
Keywords: photocatalysis; photochemistry; multicomponent reactions; visible-light synthesis; atom economy; reaction mechanisms; sustainable chemistry
(This special issue belongs to the Section Organic Chemistry)
Design, Synthesis, and Biological Evaluation of Pyridone Derivatives
edited by
submission deadline 30 Apr 2027 | Viewed by 233 | Submission Open
Keywords: pyridones; design and synthesis; extraction; semisynthesis; reactivity; fused-pyridones; biological activities
(This special issue belongs to the Section Organic Chemistry)
Molecular Design for Drug Discovery: Multitarget Strategies and Emerging Therapeutics submission deadline 30 Apr 2027 | Viewed by 219 | Submission Open
Keywords: multitarget drug discovery; medicinal chemistry; molecular design; structure-based drug design; computer-aided drug design (CADD); artificial intelligence in drug discovery; molecular docking; molecular dynamics simulation; polypharmacology; structure–activity relationship (SAR); fragment-based drug design; targeted protein degradation; PROTACs; natural products; drug repurposing; small-molecule therapeutics; kinase inhibitors; lead optimization; computational chemistry; experimental pharmacology
(This special issue belongs to the Section Medicinal Chemistry)
Animal and Plant Protein Hydrolysates: Novel Functions and Food Applications submission deadline 30 Apr 2027 | Viewed by 167 | Submission Open
Keywords: protein hydrolysates; bioactive peptides; peptide sequencing; peptide characterization; molecular mechanisms; structure–activity relationship; functional foods; techno-functional properties; enzymatic hydrolysis; microbial fermentation; fermentation-assisted hydrolysis; plant-based proteins; nutraceutical ingredients; sustainable food innovation
(This special issue belongs to the Section Food Chemistry)
Recent Advances in Bioactive Compounds from Functional Foods
edited by Merve Tomas
submission deadline 30 Apr 2027 | Viewed by 159 | Submission Open
Keywords: bioactive compounds; functional foods; bioavailability; food matrix; delivery systems; encapsulation; food processing; gastrointestinal digestion; by-product valorization
(This special issue belongs to the Section Food Chemistry)
Bioactive Compounds and Antioxidant Activity from Natural Products: New Findings and Potential Applications
edited by
submission deadline 30 Apr 2027 | Viewed by 145 | Submission Open
Keywords: antioxidant activity; bee products; bioactive compounds; chromatographic analysis; enzyme inhibition; functional foods; natural products; phenolic compounds
(This special issue belongs to the Section Natural Products Chemistry)
G Protein-Coupled Receptors (GPCR) in Drug Discovery
edited by Fatma Töre and
submission deadline 30 Apr 2027 | Viewed by 144 | Submission Open
Keywords: G protein-coupled receptors (GPCRs); drug discovery; cell signaling; molecular pharmacology; therapeutic targets; structure-based drug design
(This special issue belongs to the Section Medicinal Chemistry)
Molecular Mechanisms of Food Protein–Bioactive Compound Interactions and Functional Food Design submission deadline 30 Apr 2027 | Viewed by 136 | Submission Open
Keywords: food protein; bioactive compound; functional food; bioconjugate; protein–ligand interaction
(This special issue belongs to the Section Food Chemistry)
Food Hydrocolloids: Physicochemical and Bioactive Properties and Applications submission deadline 30 Apr 2027 | Viewed by 127 | Submission Open
Keywords: hydrocolloid; protein; polysaccharide; techno-functional; bioactive; physicochemical; films; prebiotic; encapsulation; nanoencapsulation; emulsion stabilization
(This special issue belongs to the Section Food Chemistry)
Bioactive Proteins and Peptides from Marine and Food Sources: Discovery, Mechanisms, and Biomedical Applications
edited by and
submission deadline 30 Apr 2027 | Viewed by 124 | Submission Open
Keywords: bioactive peptides; marine organisms; structure–activity relationships; bioavailability; functional foods; biomedicine; biomaterial
(This special issue belongs to the Section Natural Products Chemistry)
Nucleic Acid Mimetics: Synthesis, Probe Design and Bioanalytical Applications
edited by
submission deadline 30 Apr 2027 | Viewed by 101 | Submission Open
Keywords: nucleic acid mimics; XNA; molecular probes; sensors; bioanalytes; biomarkers
(This special issue belongs to the Section Chemical Biology)
Sustainable Bio-Based Materials: Design, Synthesis, and Applications
edited by
submission deadline 30 Apr 2027 | Viewed by 87 | Submission Open
Keywords: bio-based materials; sustainable design; green synthesis; biomass (including chitosan, chitin, starch, and biomass waste, etc.); biodegradability; structure–property relationships; functional applications (food packaging, biomedicine, catalysis, etc.); circular bioeconomy (including recycling and end-of-life)
(This special issue belongs to the Section Materials Chemistry)
Emerging Trends in Dye-Sensitized Solar Cells submission deadline 30 Apr 2027 | Viewed by 86 | Submission Open
Keywords: dye-sensitized solar cells; organic optoelectronic materials; coordination chemistry; density functional theory; molecular modeling; molecular photovoltaics; interfacial charge transfer
(This special issue belongs to the Section Colorants)
Novel Metabolism-Related Biomarkers in Cancer, 2nd Edition submission deadline 30 Apr 2027 | Viewed by 84 | Submission Open
Keywords: cancer biomarkers; personalized medicine; metabolism; glucose; amino acid; glutamine; lipid; iron
(This special issue belongs to the Section Chemical Biology)
Deep Eutectic Solvents for the Green Extraction of Bioactive Compounds from Food and Other Matrices submission deadline 30 Apr 2027 | 1 articles | Viewed by 76 | Submission Open
Keywords: natural products; bioactive compounds; green extraction; deep eutectic solvents (DESs); natural deep eutectic solvents (NADESs); food matrices; metabolomics; biological evaluation
(This special issue belongs to the Section Green Chemistry)
Functional Inorganic and Hybrid Nanomaterials: Synthesis Methods, Properties, Recent Progress, and Challenges submission deadline 30 Apr 2027 | Viewed by 72 | Submission Open
Keywords: metal nanocrystals; quantum dots; metal oxides; allotropic forms of carbon; micro and mesoporous materials; catalysts; carriers; luminophores; synthesis methods
(This special issue belongs to the Section Materials Chemistry)
Benzothiazoles as a Privileged Scaffold for Biological Active Molecules
edited by
submission deadline 30 Apr 2027 | Viewed by 69 | Submission Open
Keywords: benzothiazoles; medicinal chemistry; drug design; biological activity; antiviral agents; anti-inflammatory agents; anticancer agents; heterocyclic compounds; molecular docking; structure–activity relationship
(This special issue belongs to the Section Medicinal Chemistry)
Biopolymer Edible Films for Sustainable Packaging submission deadline 30 Apr 2027 | Viewed by 68 | Submission Open
Keywords: biopolymer edible films; sustainable packaging; food preservation; active packaging; non-conventional biopolymers; biodegradable materials
(This special issue belongs to the Section Macromolecular Chemistry)
Smart Supramolecular Scaffolds: From Molecular Recognition to Biological Function
edited by , and Ivana Nikšić-Franjić
submission deadline 30 Apr 2027 | Viewed by 67 | Submission Open
Keywords: biomimetic systems; drug delivery; host–guest chemistry; molecular recognition; nanomedicine; non-covalent interactions; self-assembly; stimuli-responsive materials; supramolecular scaffolds; tissue engineering
(This special issue belongs to the Section Materials Chemistry)
Advanced Oxidation Technologies for Water Treatment and Sustainable Environmental Applications
edited by Hüseyin Selçuk
submission deadline 30 Apr 2027 | Viewed by 65 | Submission Open
Keywords: advanced oxidation processes (AOPs); water and wastewater treatment/disinfection technologies; photocatalysis; electrochemical methods; ozonation and UV-based systems; AOPs integrated hybrid membrane systems; reactive oxidative species (ROS); sustainable environmental applications
(This special issue belongs to the Section Applied Chemistry)
Natural Products as Multi-Target Agents in Chronic and Infectious Diseases submission deadline 30 Apr 2027 | Viewed by 62 | Submission Open
Keywords: natural products; multitarget agents; phytochemicals; chronic diseases; infectious diseases; molecular mechanisms; drug discovery; systems pharmacology
(This special issue belongs to the Section Natural Products Chemistry)
Unveiling Polymer Self-Assembly: Advanced Synthesis, Structural Characterization and Mechanism Insights
edited by and
submission deadline 30 Apr 2027 | Viewed by 61 | Submission Open
Keywords: polymer; self-assembly; synthesis; characterization; mechanism
(This special issue belongs to the Section Macromolecular Chemistry)
Advances in Photocatalytic Materials for Environmental Remediation and Sustainable Energy Applications submission deadline 30 Apr 2027 | Viewed by 60 | Submission Open
Keywords: photocatalysis; semiconductor photocatalysts; hydrogen production; CO2 reduction; environmental remediation; solar energy conversion
(This special issue belongs to the Section Applied Chemistry)
Plant Extracts and Bioactive Molecules: From Molecular Mechanisms to Therapeutic Applications
edited by Nuray Bayar Muluk and Cemal Cingi
submission deadline 30 Apr 2027 | Viewed by 54 | Submission Open
Keywords: plant extract; bioactive molecules; cell culture; therapeutic effectiveness
(This special issue belongs to the Section Natural Products Chemistry)
Vibrational Spectroscopy as a Versatile Tool to Predict Protein Structure, 2nd Edition submission deadline 30 Apr 2027 | Viewed by 54 | Submission Open
Keywords: vibrational spectroscopy; Raman spectroscopy; infrared spectroscopy; protein structure; protein folding and misfolding; structure–function relationship; biomolecular interactions; surface-enhanced Raman spectroscopy (SERS)
(This special issue belongs to the Section Chemical Biology)
Advanced Fluorescent Probes and Chelators for Bioimaging and Transition Metal Sensing submission deadline 30 Apr 2027 | Viewed by 50 | Submission Open
Keywords: coordination chemistry; fluorescent probes; metal chelators; transition metal sensing; bioimaging; molecular sensing; metal complexes; chemical biology; supramolecular chemistry; photophysical properties
(This special issue belongs to the Section Inorganic Chemistry)
Design and Development of Flame-Retardant Functional Materials: From Traditional Industry to Emerging Field
edited by Bingbing Wang and
submission deadline 30 Apr 2027 | Viewed by 49 | Submission Open
Keywords: flame-retardant functional materials; multifunctional polymer composites; sustainable flame retardants; halogen-free flame retardants; bio-based fire-safety materials; battery fire protection; thermal runaway mitigation; smart fire-warning coatings; fire-safety engineering
(This special issue belongs to the Section Applied Chemistry)
Advanced Analytical Tools for Characterization and Quality Control of Food, Drugs, and Natural Active Ingredients, 4th Edition submission deadline 30 Apr 2027 | Viewed by 46 | Submission Open
Keywords: authentication; classification; pharmaceutical drugs; food; quality control; natural products; geographical origin; chemometrics
(This special issue belongs to the Section Analytical Chemistry)
Advances in the Application of Nanomaterials in Drug Delivery and Nanomedicine
edited by and Giuseppina Bozzuto
submission deadline 30 Apr 2027 | Viewed by 45 | Submission Open
Keywords: nanomaterials; drug delivery; liposomes; nanomedicine; targeted drug delivery; regenerative medicine; tissue engineering; biomaterials; theranostics; controlled release
(This special issue belongs to the Section Nanochemistry)
Recent Research on Modeling Interaction in Biomolecules
edited by Jaroslav V. Burda
submission deadline 30 Apr 2027 | Viewed by 44 | Submission Open
Keywords: quantum theory of molecules; molecular dynamics; Monte Carlo simulations; nucleic acids and protein dynamics; anticancer treatment; machine learning; data-base formation
(This special issue belongs to the Section Computational and Theoretical Chemistry)
Peptide-Decorated Self-Assembled Nanoparticles for Cancer Theranostics: Advances in Biomedicine
edited by and Feng Cao
submission deadline 30 Apr 2027 | Viewed by 42 | Submission Open
Keywords: self-assembly; peptide nanoparticles; cancer therapy; theranostics; tumor targeting
(This special issue belongs to the Section Nanochemistry)
Advanced Fluorescent Probes: Design, Synthesis, and Applications
edited by Wei Chen
submission deadline 30 Apr 2027 | Viewed by 39 | Submission Open
Keywords: fluorescent probes; bioimaging; fluorescent dyes; near-infrared fluorescence
(This special issue belongs to the Section Analytical Chemistry)
Multifunctional Metal Complexes for Medicinal Applications
edited by and Christian Parry
submission deadline 30 Apr 2027 | Viewed by 39 | Submission Open
Keywords: bioinorganic chemistry; coordination complexes; medicinal inorganic chemistry; prochelators; stimuli-responsive ligands; metal homeostasis; theranostics; metalloenzyme inhibitors; targeted therapeutics
(This special issue belongs to the Section Inorganic Chemistry)
Recent Advances in Oilfield Chemistry and Enhanced Oil Recovery
edited by and Lu Lai
submission deadline 30 Apr 2027 | Viewed by 19 | Submission Open
Keywords: oilfield chemistry; enhanced oil recovery; colloids and interfacial chemistry; wettability alteration; nanomaterials; CO2 foam; computational chemistry; molecular simulations
(This special issue belongs to the Section Applied Chemistry)
Advanced Functional Materials: Challenges and Opportunities, 2nd Edition
edited by Ruijin Yu
submission deadline 30 Apr 2027 | Submission Open
Keywords: advanced functional materials; functional nanomaterials; environmental materials; structural characterization; fluorescence property; photoelectric property; electrical property; medical application
(This special issue belongs to the Section Materials Chemistry)
Recent Advances in Computer-Aided Drug Design and Drug Discovery, 2nd Edition
edited by and Dingguo Xu
submission deadline 1 May 2027 | 1 articles | Viewed by 954 | Submission Open
Keywords: computer-aided drug design; structure-based drug design; ligand-based drug design; fragment-based drug design; pharmacophore; QSAR; molecular modelling; artificial intelligence
(This special issue belongs to the Section Computational and Theoretical Chemistry)
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