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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 polices 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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Recent Advances in Proton-Conducting Crystalline Porous Materials
edited by Gang Li and Zhiqiang Shi
submission deadline 31 Jan 2025 | Viewed by 71 | Submission Open
Keywords: metal– organic frameworks (MOFs); covalent– organic frameworks (COFs); hydrogen-bonded organic frameworks (HOFs); porous materials; proton conduction
(This special issue belongs to the Section Materials Chemistry)
Synthesis, Structure and Ultrafast Spectroscopy of Photosensitizers with Earth-Abundant Transition Metals submission deadline 31 Jan 2025 | Viewed by 62 | Submission Open
Keywords: earth-abundant transition metals; photosensitizers; coordination complexes; excited state dynamics; photocatalysis
(This special issue belongs to the Section Photochemistry)
Natural Products: Isolation, Analysis and Biological Activity, 2nd Edition
edited by Hazem Salaheldin Elshafie and
submission deadline 31 Jan 2025 | Viewed by 58 | Submission Open
Keywords: essential oils; plant extracts; biological activities; antiproliferative activity; enzymatic inhibitor activity; phytotoxic activity; bioactive compounds in natural products; secondary metabolites; structure– activity relationships; antimicrobial activity; phytopathogens
(This special issue belongs to the Section Natural Products Chemistry)
Recent Advances in Functional Composite Materials
edited by
submission deadline 31 Jan 2025 | Viewed by 51 | Submission Open
Keywords: functional composites; material innovation; enhanced properties; nanotechnology; smart materials
(This special issue belongs to the Section Materials Chemistry)
The Machine Learning, Applications in the Discovery of New Bioactive Molecules, 2nd Edition
edited by
submission deadline 31 Jan 2025 | Viewed by 45 | Submission Open
Keywords: machine learning; deep learning; computer-aided drug design; ligand-based approaches; structure-based approaches; in silico compound profiling; virtual screening; ADMET property evaluation
(This special issue belongs to the Section Medicinal Chemistry)
Metabolites from Algae: Discovery, Identification and Multifaceted Applications submission deadline 31 Jan 2025 | Viewed by 34 | Submission Open
Keywords: marine algae-derived metabolites; marine photosynthetic organisms as a source of drugs; nutraceuticals; cosmeceuticals; biotechnological applications of macro- and microalgae; novel strategies for industrial production of marine-derived compounds
(This special issue belongs to the Section Natural Products Chemistry)
Inorganic Nonlinear Optical Materials
edited by Jie Ling
submission deadline 31 Jan 2025 | Viewed by 19 | Submission Open
Keywords: nonlinear optical (NLO) materials; structural characterization; optical property; single crystals; crystal growth; metal oxides; chalcogenides; halides; pnictides; machine learning
(This special issue belongs to the Section Inorganic Chemistry)
Recent Advance in the Cycloaddition Reaction for the Synthesis of Heterocycles
edited by
submission deadline 31 Jan 2025 | Viewed by 18 | Submission Open
Keywords: cycloaddition; metal catalysis; asymmetric catalysis; photocatalysis; electrocatalysis; C-H activation cycloaddition; annulation
(This special issue belongs to the Section Organic Chemistry)
Molecular Docking for Drug Design submission deadline 31 Jan 2025 | Viewed by 17 | Submission Open
Keywords: molecular docking; drug discovery; binding strength of the complex; structure of protein; small molecules
(This special issue belongs to the Section Computational and Theoretical Chemistry)
Natural Products in Anticancer Activity: 2nd Edition submission deadline 31 Jan 2025 | Viewed by 17 | Submission Open
Keywords: natural products; anticancer; drug; nature; molecule
(This special issue belongs to the Section Natural Products Chemistry)
Green Chemistry Approaches to Analysis and Environmental Remediation
edited by
submission deadline 31 Jan 2025 | Viewed by 16 | Submission Open
Keywords: chromatography; mass spectrometry; extraction; green analytical chemistry; emerging contaminants
(This special issue belongs to the Section Analytical Chemistry)
Saline Wastewater: Characteristics and Treatment Technologies, 2nd Edition
edited by and
submission deadline 31 Jan 2025 | Viewed by 15 | Submission Open
Keywords: saline wastewater; salinity; resource utilization; crystallization; electrodialysis; membrane; solubility; solution microstructure
(This special issue belongs to the Section Applied Chemistry)
Porous Carbons for Gas Adsorption and Capture
edited by
submission deadline 31 Jan 2025 | Viewed by 14 | Submission Open
Keywords: porous carbons; gas adsorption; gas capture; carbon sequestration; surface chemistry; material synthesis
(This special issue belongs to the Section Applied Chemistry)
Functional Nanomaterials and Their Applications in the Environment Remediation
edited by and Muhammad Irfan
submission deadline 31 Jan 2025 | Viewed by 14 | Submission Open
Keywords: nanoremediation; environmental cleanup; pollutant removal; sustainable nanomaterials; heavy metal remediation; organic pollutant degradation; nano-ecotoxicology
(This special issue belongs to the Section Materials Chemistry)
Bioactive Compounds against Parasites, Bacteria and Related Diseases–Third Edition submission deadline 31 Jan 2025 | Viewed by 13 | Submission Open
Keywords: bioactive compounds; essential oils; herbal extracts; fungi; mycoses; helmints parasite; protozoa parasite; arthropods parasite; parasitoses; anti-drug-resistant parasites; antifungal-resistant molds; yeast; Gram-positive bacteria; Gram-negative bacteria; antibiotic-resistant bacteria; bacterial infections; animal infections; human infections; zoomotic infections
(This special issue belongs to the Section Natural Products Chemistry)
Recent Research Progress of Novel Ion Adsorbents submission deadline 28 Feb 2025 | 3 articles | Viewed by 1470 | Submission Open
Keywords: synthesis of adsorbents; adsorbents regeneration; ionic adsorbates; purification of water; removal of impurities; adsorption mechanisms; desorption; equilibrium data; adsorption isotherms; kinetic models
(This special issue belongs to the Section Physical Chemistry)
Study on Preparation and Application of Environmental Purification Materials
edited by Zhihua Xu
submission deadline 28 Feb 2025 | 1 articles | Viewed by 1229 | Submission Open
Keywords: environmental purification; functional materials; advanced oxidation technology; nano/meso-catalyst; photothermal catalysis; pollutant removal
(This special issue belongs to the Section Materials Chemistry)
Role of Natural Products in Inflammation submission deadline 28 Feb 2025 | 1 articles | Viewed by 870 | Submission Open
Keywords: inflammation; natural compounds; terrestrial plants; marine plants; NF-kB; hemoxygenase and cyclooxygenase pathways
(This special issue belongs to the Section Natural Products Chemistry)
Research Advances in Organofluorine Chemistry
edited by **-Hong Lin
submission deadline 28 Feb 2025 | 1 articles | Viewed by 506 | Submission Open
Keywords: fluorine fluorination reactions; fluorine incorporation; organic fluorine compounds; novel fluorine-containing reagents; fluorination synthetic strategies; fluorine catalysis
(This special issue belongs to the Section Organic Chemistry)
Emulsion Polymerization and Functional Polymer Microspheres
edited by Chengyou Kan and Wei Deng
submission deadline 28 Feb 2025 | Viewed by 94 | Submission Open
Keywords: emulsion polymerization; mini emulsion polymerization; dispersion polymerization; suspension polymerization; functionalization; polymer microspheres; microcapsules; characterization; morphology control; structure– property relationship; polymer nanocomposite; application
(This special issue belongs to the Section Materials Chemistry)
Advances in Chemistry of Cosmetics
edited by
submission deadline 28 Feb 2025 | Viewed by 61 | Submission Open
Keywords: melanocytes (melanogenesis); fibroblasts (anti-wrinkles); papilla (hair growth); keratinocytes (skin health); macrophages (inflammation); adipocytes (obesity); natural products; organic synthesis; enzyme inhibitors; molecular docking
(This special issue belongs to the Section Medicinal Chemistry)
Enantioselective Synthesis, Enantiomeric Separations and Chiral Recognition: 3rd Edition submission deadline 28 Feb 2025 | Viewed by 55 | Submission Open
Keywords: enantioselective synthesis; enantioseparation; chiral analyses; chiral recognition; chiral sensors
Research Progress of New Antimicrobial Drugs submission deadline 28 Feb 2025 | Viewed by 42 | Submission Open
Keywords: synthesis of new antimicrobials; bioactive compounds; antimicrobial derivatives; synthetic and natural compounds; pathogens and opportunistic microbes; prevention and treatment; antibiofilm; discovery of antimicrobials
(This special issue belongs to the Section Medicinal Chemistry)
Waste and By-Products from Agricultural Production for Innovative Health Applications, Second Edition submission deadline 28 Feb 2025 | Viewed by 39 | Submission Open
Keywords: botanical characterization; pharmacological activity; ecotoxicological fingerprint; phytochemistry; analytical methods
(This special issue belongs to the Section Natural Products Chemistry)
New Research on Novel Photo-/Electrochemical Materials
edited by and
submission deadline 28 Feb 2025 | Viewed by 30 | Submission Open
Keywords: photo-/electrochemistry; water splitting; fuel cell; zinc air battery; nitrogen reduction reaction; CO2 reduction reaction; photocatalytic degradation; gas sensor
(This special issue belongs to the Section Materials Chemistry)
Advancements in Analytical Chemistry for the Analysis and Detection of Food and Environment
edited by
submission deadline 28 Feb 2025 | Viewed by 18 | Submission Open
Keywords: analytical chemistry; food analysis; environmental analysis; innovative qualitative/quantitative detection techniques; trace analysis; food quality/safety; environmental protection/management
(This special issue belongs to the Section Analytical Chemistry)
Processing of Materials by Supercritical Fluids, 3rd Edition
edited by
submission deadline 28 Feb 2025 | Viewed by 14 | Submission Open
Keywords: supercritical fluids; materials; aerogels; particles; membranes; fibers; scaffolds
(This special issue belongs to the Section Green Chemistry)
Functional Foods and Dietary Bioactives in Human Health submission deadline 31 Mar 2025 | 6 articles | Viewed by 7776 | Submission Open
Keywords: food; nutrition; human health; functional foods; bioactive molecules; food products; nutraceutics
(This special issue belongs to the Section Natural Products Chemistry)
Phytochemistry, Human Health and Molecular Mechanisms
edited by Valeria Naponelli and
submission deadline 31 Mar 2025 | 2 articles | Viewed by 2936 | Submission Open
Keywords: bioactive compounds; bioavailability; extraction methods; biological activities; functional applications; nutraceuticals; human metabolism; toxicity; bioactive-gut microbiota relationships
(This special issue belongs to the Section Natural Products Chemistry)
Advanced Analytical Techniques for the Detection and Quantification of Emerging Contaminants submission deadline 31 Mar 2025 | 1 articles | Viewed by 494 | Submission Open
Keywords: extraction protocols; method development; determination of emerging contaminants; fate and transformation of contaminants; environmental monitoring; advanced separation techniques; high-resolution mass spectrometry; identification workflows
(This special issue belongs to the Section Analytical Chemistry)
Supramolecular Host/Guest Compounds and Their Prospects for Multifunctional Materials
edited by Angela Danil De Namor and Nawal Al Hakawati
submission deadline 31 Mar 2025 | Viewed by 66 | Submission Open
Keywords: supramolecular chemistry; host-guest chemistry; macrocycles and cages; self-assembly; supramolecular materials
(This special issue belongs to the Section Macromolecular Chemistry)
Advance in Gas Hydrates: Formation, Structures, Properties and Applications
edited by Yu Wei, , Jose G. Delgado-Linares and
submission deadline 31 Mar 2025 | Viewed by 57 | Submission Open
Keywords: gas hydrate structures; gas hydrate properties; gas hydrate formation and dissociation; gas hydrate applications; gas hydrate flow assurance; gas hydrate exploration and production; gas hydrate modeling and molecular simulation
Functional Nanomaterials for Food Safety and Biomedicine Analysis Applications
edited by
submission deadline 31 Mar 2025 | Viewed by 20 | Submission Open
Keywords: functional nanomaterials; biosensors; food safety; biomedicine analysis; disease diagnosis
(This special issue belongs to the Section Applied Chemistry)
Advances in Homogeneous/Heterogeneous Photocatalysis to the Degradation of Pollutants in Water submission deadline 30 Apr 2025 | 3 articles | Viewed by 4055 | Submission Open
Keywords: advanced oxidation processes; heterogeneous photocatalysis; homogeneous photocatalysis; water and wastewater treatment; pollutant abatement; microorganism inactivation
(This special issue belongs to the Section Photochemistry)
Functional Crystal Materials: Challenges and Opportunities
edited by
submission deadline 30 Apr 2025 | Viewed by 108 | Submission Open
Keywords: functional crystal materials; crystal engineering; structure-property relationship; multi stimulus responsive crystals; artificial intelligence; molecular self-assembly; meso-scale
(This special issue belongs to the Section Materials Chemistry)
From Atoms to Applications: Computational Design, Prediction, and Simulation of Materials submission deadline 30 Apr 2025 | Viewed by 63 | Submission Open
Keywords: molecular modeling; machine learning; materials science; computational techniques; theoretical and computational chemistry; molecular dynamics
(This special issue belongs to the Section Physical Chemistry)
Advanced Electrode Materials for Energy Storage and Conversion Devices
edited by , and Shude Liu
submission deadline 30 Apr 2025 | Viewed by 16 | Submission Open
Keywords: supercapacitors; batteries; transition metal compounds; carbonaceous materials; organic polymer materials; MOF and MOF-derived materials; materials design; materials analysis
(This special issue belongs to the Section Electrochemistry)
Extraction, Identification and Isolation of Chemical Compounds in Natural Matrices, 2nd Edition
edited by
submission deadline 15 May 2025 | Viewed by 546 | Submission Open
Keywords: bioactive compounds; natural matrices; health benefits; industry potential; natural molecules
(This special issue belongs to the Section Natural Products Chemistry)
Synthesis and Crystal Structure Studies of Metal Complexes
edited by Anna Świtlicka
submission deadline 30 May 2025 | Viewed by 16 | Submission Open
Keywords: synthesis; crystal structure; physical properties; X-ray diffraction; coordination complexes; d- and f-block metal atoms; functional materials; applications
(This special issue belongs to the Section Inorganic Chemistry)
Exploration of Natural Compounds: Pharmaceutical, Phytochemical and Biological Analyses—2nd Edition submission deadline 31 May 2025 | 1 articles | Viewed by 697 | Submission Open
Keywords: natural products; structure elucidation; natural-product-based hybrids; herbal formulations; biotransformation; biological properties
(This special issue belongs to the Section Natural Products Chemistry)
Recent Advances in Organochalcogen Chemistry submission deadline 31 May 2025 | Viewed by 202 | Submission Open
Keywords: sulfur; selenium; tellurium; chalcogen bond; materials science; synthetic methodologies; catalysis; heterocycles; biomimetics
(This special issue belongs to the Section Organic Chemistry)
The Chemistry, Bioactivity and Analysis of Essential Oils: Applications for Foods, Drugs and Cosmetics submission deadline 31 May 2025 | Viewed by 89 | Submission Open
Keywords: essential oils; volatile compounds; bioactivity; extraction methods; innovative and conventional techniques; natural food preservatives; industrial application
(This special issue belongs to the Section Natural Products Chemistry)
Plant-Based Food Science: Chemical Composition and Biological Activity
edited by Barbara Soldo and
submission deadline 31 May 2025 | Viewed by 71 | Submission Open
Keywords: plants; extraction; chemical composition; biologically active compounds; antioxidation; antitumor activity; microbiological activity
(This special issue belongs to the Section Food Chemistry)
Deep Learning in Molecular Science and Technology
edited by and
submission deadline 30 Jun 2025 | 3 articles | Viewed by 4214 | Submission Open
Keywords: deep learning; data informatics; physical chemistry; biochemistry; materials chemistry
Advanced Porous Materials for the Elimination of Chemical Contaminants and Residues
edited by Li Yu and
submission deadline 30 Jun 2025 | Viewed by 128 | Submission Open
Keywords: chemical contaminants; residues; food safety; food hazards; elimination; mechanism; advanced porous materials
(This special issue belongs to the Section Materials Chemistry)
Advances in Green Solvents for Analytical Chemistry: Deep Eutectic Solvents and Biosolvents submission deadline 30 Jun 2025 | Viewed by 20 | Submission Open
Keywords: eutectic Solvents; biosolvents; green chemistry; microextraction techniques; environmentally friendly methods; green sample preparation; chromatography modifiers; sample preparation
(This special issue belongs to the Section Analytical Chemistry)
Biomass-Derived Nanomaterials: Sustainable Production and Application
edited by
submission deadline 3 Jul 2025 | 3 articles | Viewed by 6905 | Submission Open
Keywords: carbon nanotubes; nanocellulose; nanostructures; lignin nanoparticles; top-down approaches; surface functionalization; applications; cytoxicity; toxicology; life-cycle assessment
(This special issue belongs to the Section Nanochemistry)
Natural Products with Antiviral, Anti-inflammatory and Immunomodulatory Activities
edited by
submission deadline 7 Jul 2025 | 3 articles | Viewed by 6165 | Submission Open
Keywords: antiviral; anti-inflammatory and immunomodulatory activities; rational drug design; structural modification; biotransformation; chemical biology; mechanism
(This special issue belongs to the Section Natural Products Chemistry)
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