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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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Innovative Analytical Approaches for the Isolation and Characterization of Drugs, Metabolites and Natural Bioactive Compounds submission deadline 30 Jun 2026 | 1 articles | Viewed by 525 | Submission Open
Keywords: analytical chemistry; chromatography; extraction; green chemistry; bioactive compounds; drugs; metabolites
(This special issue belongs to the Section Analytical Chemistry)
Supramolecular Catalytic Systems Build on Macrocycle-Base Host-Guest Interactions
edited by
submission deadline 30 Jun 2026 | 1 articles | Viewed by 513 | Submission Open
Keywords: supramolecular catalysis; host– guest systems; macrocycles; noncovalent interactions; microenvironments; activity; stimuli-responsiveness; enantioselectivity/selectivity; transition state stabilization; product inhibition; tandem catalysis
(This special issue belongs to the Section Organic Chemistry)
Advances in Amylases, 2nd Edition
edited by
submission deadline 30 Jun 2026 | Viewed by 509 | Submission Open
Keywords: enzyme; alpha-amylase enzyme; starch and glycogen; gut microbiome oriented study
(This special issue belongs to the Section Bioorganic Chemistry)
Hybrid and Hierarchical Zeolite-Based Platforms for Sustainable Remediation and Resource Recovery
edited by and
submission deadline 30 Jun 2026 | Viewed by 481 | Submission Open
Keywords: hybrid and hierarchical zeolite-based materials; environmental remediation technologies; PFAS and emerging persistent pollutants; water; air; and soil treatment; functional porous platforms; natural; synthetic; composite; and nano-zeolites; structure– contaminant interaction mechanisms; circular economy and sustainable applications
(This special issue belongs to the Section Materials Chemistry)
Insight into Organic Semiconductor Materials
edited by Runfeng Chen and Chao Zheng
submission deadline 30 Jun 2026 | 1 articles | Viewed by 363 | Submission Open
Keywords: organic semiconductors; organic photonics; inorganic/organic hybrid materials; excitons; electroluminescence; photovoltaics; vacuum/solution process; energy transfer
(This special issue belongs to the Section Materials Chemistry)
Biobased Chemicals: Environmentally Friendly Solutions for Sustainable Development, 3rd Edition
edited by
submission deadline 30 Jun 2026 | Viewed by 324 | Submission Open
Keywords: bioproducts; biochar; hydrochar; by-products; biofuels; biomass; hydrothermal carbonization; torrefaction
Plant-Based Bioactives and Sustainable Sources: Unlocking the Potential of Underutilized Resources submission deadline 30 Jun 2026 | Viewed by 303 | Submission Open
Keywords: valorization of agricultural and food processing by-products as sources of bioactives; extraction and purification techniques for plant-derived bioactive compounds; bioactive peptides and polyphenols from underutilized or wild plant species; functional and health-promoting properties of plant-based bioactives; sustainable biorefinery approaches for bioactive recovery; In vitro and in vivo evaluation of bioactivity (e.g.; antioxidant; anti-inflammatory; antimicrobial); applications in functional foods; nutraceuticals; and cosmeceuticals; environmental and economic assessments of sustainable bioactive sourcing
(This special issue belongs to the Section Natural Products Chemistry)
Advances in Porous Organic Materials: Syntheses, Structures and Applications
edited by Tianqiong Ma, Wankai An and
submission deadline 30 Jun 2026 | Viewed by 285 | Submission Open
Keywords: porous organic materials; porous organic polymers (POPs); covalent organic frameworks (COFs); conjugated microporous polymers (CMPs); porous aromatic frameworks (PAFs); polymers of intrinsic microporosity (PIMs); hyper-cross-inked polymers (HCPs); porous organic cages
(This special issue belongs to the Section Materials Chemistry)
Advances in Solid-State Culture for Obtaining Bioactive Molecules submission deadline 30 Jun 2026 | Viewed by 263 | Submission Open
Keywords: solid-state culture; bioactive molecules; bioactive compounds characterization; biomanufacturing process design; bioprocess optimization
Microbe Metabolites as Functional and Bioactive Components in Food
edited by
submission deadline 30 Jun 2026 | Viewed by 258 | Submission Open
Keywords: microbial metabolites; functional food; bioactive compounds; fermentation; gut microbiota; single-cell protein; microbial lipids; natural pigments; probiotics
Synthesis, Characterization and Anticancer Activities of Metal Complexes
edited by
submission deadline 30 Jun 2026 | Viewed by 256 | Submission Open
Keywords: in vitro activity; in vivo activity; metal complex; biological studies; anticancer activity; bimetallic complexes; mechanistic studies
(This special issue belongs to the Section Inorganic Chemistry)
Recent Advances in Cannabis and Hemp Research—2nd Edition
edited by
submission deadline 30 Jun 2026 | Viewed by 252 | Submission Open
Keywords: Cannabis sativa; hemp; cannabinoids; terpenes; phenolics; secondary metabolites; by-products; biological activity; protein; polysaccharide
(This special issue belongs to the Section Natural Products Chemistry)
Modern Sample Preparation Approaches for Separation Science, 2nd Edition
edited by
submission deadline 30 Jun 2026 | Viewed by 250 | Submission Open
Keywords: sample preparation; enrichment techniques; sorption-based methods; virtual sample preparation; microextraction techniques; new analytical strategies; separation techniques
(This special issue belongs to the Section Analytical Chemistry)
New Insights into Porous Carbon Materials for a Sustainable Future
edited by
submission deadline 30 Jun 2026 | Viewed by 246 | Submission Open
Keywords: porous carbon materials; biomass-derived carbon; waste-to-carbon; energy storage; carbon capture; supercapacitors; green synthesis; functionalized carbon; environmental applications
Synthesis and Characterization of Heterocycles with Potential Applications submission deadline 30 Jun 2026 | Viewed by 245 | Submission Open
Keywords: heterocycles; synthesis; design; characterization; green methods; applications
(This special issue belongs to the Section Organic Chemistry)
Terpenes, Steroids and Their Derivatives, 3rd Edition
edited by
submission deadline 30 Jun 2026 | Viewed by 244 | Submission Open
Keywords: terpene and steroid chemistry; biochemistry; repurposing; and practical utilization; terpene and steroid derivative synthesis; isolation and analysis of terpenes and steroids; terpene and steroid medicinal; as well as cosmetic; utilization; fluorescent labelling; bio-imaging
Bioactive Natural Product Compounds in Cancer Prevention and Therapy submission deadline 30 Jun 2026 | Viewed by 237 | Submission Open
Keywords: natural product; cytotoxic; bioactivity mechanism; cancer; drug discovery; drug delivery; chemoprevention
(This special issue belongs to the Section Natural Products Chemistry)
Drug Resistance and Antimicrobial Activities of Natural Products submission deadline 30 Jun 2026 | 1 articles | Viewed by 215 | Submission Open
Keywords: natural products; antimicrobial resistance; antibiofilm activity; synergy; drug discovery
(This special issue belongs to the Section Natural Products Chemistry)
Advances in Computer-Aided Drug Design and Synthesis
edited by
submission deadline 30 Jun 2026 | Viewed by 210 | Submission Open
Keywords: natural products; extraction; pharmacological potential; biological activities
Circular Economy: Agri-Food Byproducts as Source of Bioactive Compounds, 2nd Edition submission deadline 30 Jun 2026 | Viewed by 208 | Submission Open
Keywords: agri-food byproducts; plant extracts; food extracts; essential oils; bioactive compounds; nutraceuticals; micromorphology; phytochemistry; health effects; eco-sustainability
(This special issue belongs to the Section Green Chemistry)
Applications of Natural Polymers in Biomedicine submission deadline 30 Jun 2026 | Viewed by 207 | Submission Open
Keywords: polymer biomaterials; biopolymers; proteins; polysaccharides; gels; hydrogels; scaffolds; films
(This special issue belongs to the Section Medicinal Chemistry)
Design of Chemically Recyclable Polymers in Sustainable Chemistry: A Minimalist Perspective
edited by Francesco Stellacci, Youwei Ma and Ping Yu
submission deadline 30 Jun 2026 | Viewed by 204 | Submission Open
Keywords: chemically recyclable polymers; sustainable polymers; biomass-based polymers; dynamic (covalent) bonds; minimalist sustainable design
(This special issue belongs to the Section Green Chemistry)
Novel Flame Retardant Materials
edited by
submission deadline 30 Jun 2026 | Viewed by 196 | Submission Open
Keywords: novel flame retardants; flame-retardant polymers; bio-based flame retardants; flame-retardant coatings; environmentally friendly flame-retardant textiles; flame-retardant nanocomposites; flame retardant mechanism research
(This special issue belongs to the Section Materials Chemistry)
Nicotinamide Adenine Dinucleotide (NAD) Metabolism and Related Drug Compounds (Second Edition) submission deadline 30 Jun 2026 | Viewed by 195 | Submission Open
Keywords: NAD metabolism; NAD enzymology; NAD biosynthesis; NAD degradation; pyridine drugs; niacin; vitamin B3; drug discovery; NAD-based therapeutics
(This special issue belongs to the Section Chemical Biology)
Natural Products for Chronic Disease: Mechanisms and Applications
edited by and
submission deadline 30 Jun 2026 | Viewed by 194 | Submission Open
Keywords: natural products; chronic diseases; mechanism; herbal compound; drug delivery system; molecular modification
(This special issue belongs to the Section Natural Products Chemistry)
Bioavailability of Bioactive Food Compounds submission deadline 30 Jun 2026 | Viewed by 193 | Submission Open
Keywords: bioactivity; bioavailability; in vitro; metabolism; gastrointestinal models; dietary phytochemicals; food processing technology; non-thermal treatment
(This special issue belongs to the Section Food Chemistry)
Nanotechnology in the Development of Battery Materials
edited by , Xiaoli Fan and Xianguang Meng
submission deadline 30 Jun 2026 | Viewed by 186 | Submission Open
Keywords: nanotechnology; batteries; Li/Na/K/Ca/Mg/Al battery; fuel cell; metal-air battery; solar cell; solid-state battery
(This special issue belongs to the Section Nanochemistry)
Feature Review Papers in Electrochemistry, 2nd Edition submission deadline 30 Jun 2026 | Viewed by 180 | Submission Open
Keywords: electrochemical science; electrochemical technology; environmental applications; new materials; energy conversion; energy storage; electrocatalysis; combined electrochemical technologies
(This special issue belongs to the Section Electrochemistry)
Chemical Transformations and Analysis in Food: Nutrition, Flavor Compounds, and Microbiological Research submission deadline 30 Jun 2026 | 1 articles | Viewed by 175 | Submission Open
Keywords: flavor compounds; fermented food; flavor formation; flavor compound production/synthesis
(This special issue belongs to the Section Food Chemistry)
X-Ray Spectroscopy of Biomolecules
edited by Lucas Schwob, Sadia Bari and Marta Berholts
submission deadline 30 Jun 2026 | Viewed by 175 | Submission Open
Keywords: X-ray spectroscopy; biomolecules; structure-function relationship; time-resolved spectroscopy; core-level ionization; electronic structure and dynamics; charge migration; theoretical modeling
(This special issue belongs to the Section Analytical Chemistry)
Molecular Spectroscopy and Molecular Structure
edited by , and Yukihiro Ozaki
submission deadline 30 Jun 2026 | Viewed by 168 | Submission Open
Keywords: molecular spectroscopy; molecular structure; applications in biological sciences; applications in materials science; molecular interaction; hydrogen bonds; methodological development; quantum chemical calculation
(This special issue belongs to the Section Photochemistry)
Research and Application of Plant Sourced Polysaccharides—3rd Edition
edited by
submission deadline 30 Jun 2026 | Viewed by 167 | Submission Open
Keywords: polysaccharide; characterization; structure; physiochemical properties; functional activity
(This special issue belongs to the Section Natural Products Chemistry)
Synthesis and Characterization of Hybrid Biomaterials for Life Sciences submission deadline 30 Jun 2026 | Viewed by 165 | Submission Open
Keywords: hybrid material; biomaterials; drug release; antimicrobial test; chemical characterization; natural polymers; bioactivity assessment; bioactivity
(This special issue belongs to the Section Materials Chemistry)
Exploring the Nanomaterials in Electrochemical Sensor: From Design to Application
edited by Hongbo Li and
submission deadline 30 Jun 2026 | Viewed by 159 | Submission Open
Keywords: nanomaterials; metal– organic frameworks; quantum dots; covalent– organic frameworks; polymers; organic– inorganic nanocomposites; electrochemical sensors
(This special issue belongs to the Section Materials Chemistry)
Functional Foods: Bioactive Compounds, Antioxidants and Anti-Inflammatory Activities, 2nd Edition submission deadline 30 Jun 2026 | Viewed by 150 | Submission Open
Keywords: functional foods; bioactive compounds; antioxidants; anti-inflammatory; nutraceuticals; isolation of bioactives; interactions of bioactives; food matrix; bioaccessibility; bioavailability
(This special issue belongs to the Section Food Chemistry)
Bioactive Secondary Metabolites in Natural Products submission deadline 30 Jun 2026 | Viewed by 149 | Submission Open
Keywords: bioactive metabolites from mushrooms; medicinal plant metabolites; pro-health secondary metabolites from natural products; antiaging natural sources metabolites; natural dietary supplements
(This special issue belongs to the Section Natural Products Chemistry)
Nanocarriers for Diagnostics, Imaging and Drug Delivery
edited by Jie Pan and Yonghui Liu
submission deadline 30 Jun 2026 | Viewed by 144 | Submission Open
Keywords: nanocarriers; diagnostics; imaging; drug delivery; targeted therapy
(This special issue belongs to the Section Nanochemistry)
Molecular Docking, Molecular Dynamics and Antiparasitic Evaluations of Natural Products
edited by and Márcia Machado Marinho
submission deadline 30 Jun 2026 | Viewed by 142 | Submission Open
Keywords: natural products; molecular docking; molecular dynamics; antiprotozoal; virtual screening; drug discovery
(This special issue belongs to the Section Natural Products Chemistry)
Advances in Molecular Targets and Signaling Pathways for Drug Discovery
edited by
submission deadline 30 Jun 2026 | Viewed by 139 | Submission Open
Keywords: medicinal chemistry; novel chemical scaffolds against molecular targets; new chemical ligands of receptors; chemical compounds in drug delivery
(This special issue belongs to the Section Medicinal Chemistry)
Functional Carbon Materials from Biomass for Environmental Applications
edited by
submission deadline 30 Jun 2026 | Viewed by 138 | Submission Open
Keywords: biomass-derived carbon; functional carbon materials; activated carbon; biochar; porous carbon; surface functionalization; structure-property relationships; biomass valorization; circular economy; environmental remediation; water treatment; adsorption and catalysis; electrocatalysis; green synthesis; sustainable materials
(This special issue belongs to the Section Materials Chemistry)
Perovskite Materials for Application in Sustainable Energy Technologies
edited by Ndzondelelo Bingwa
submission deadline 30 Jun 2026 | Viewed by 130 | Submission Open
Keywords: perovskites; renewable energy; photocatalysis; biofuels; hydrogen; metal oxides; heterogeneous catalysis
(This special issue belongs to the Section Materials Chemistry)
Biologically Active Nitrogen-Containing Heterocyclic Compounds
edited by Monika Wujec and Sara Janowska
submission deadline 30 Jun 2026 | Viewed by 126 | Submission Open
Keywords: nitrogen-containing heterocyclic compounds; biological activity; drug design; molecular docking; synthesis; structure– activity relationship (SAR); medicinal chemistry; bioactive molecule
(This special issue belongs to the Section Medicinal Chemistry)
Analysis and Application of Bioactive Compounds in Functional Foods
edited by
submission deadline 30 Jun 2026 | Viewed by 123 | Submission Open
Keywords: nutritional bioactive compounds; non-nutritional bioactive compounds; functional foods development; food supplement; green extraction approach; new analytical methods; bioaccessibility; bioavailability
(This special issue belongs to the Section Food Chemistry)
Plant Natural Products: From Classical to (Bio)Technological and AI Research submission deadline 30 Jun 2026 | Viewed by 122 | Submission Open
Keywords: extraction and bioassay-guided isolation; bioactivities (communicable diseases like infections and non-communicable diseases like cancer; hyperglycemia; hypertension; diabetes; and hyperpigmentation); plant biosynthetic enzymes; green extraction technology; plant metabolomics and proteomics; molecular simulation (molecular docking and molecular dynamics); chemoinformatics (SAR and QSAR); AI (machine learning and deep learning)
(This special issue belongs to the Section Natural Products Chemistry)
Chemical Composition, Antiradical Potential and Sensory Qualities of Lesser-Known Fruits submission deadline 30 Jun 2026 | Viewed by 115 | Submission Open
Keywords: chemical composition; lesser-known fruits; antiradical potential; sensory and instrumental analysis; health-promoting activity
(This special issue belongs to the Section Food Chemistry)
New Achievements and Challenges in Food Chemistry, 2nd Edition
edited by and Qiuming Chen
submission deadline 30 Jun 2026 | Viewed by 114 | Submission Open
Keywords: food processing innovations; alternative proteins; bioactive compounds; food safety; food storage; flavor chemistry; food enzyme design; AI-assisted technologies; novel analytical methods
(This special issue belongs to the Section Food Chemistry)
Rational Design, Synthesis, and Evaluation of Small-Molecule Anticancer Agents
edited by and Ganga Reddy Velma
submission deadline 30 Jun 2026 | Viewed by 113 | Submission Open
Keywords: drug design; medicinal chemistry; organic synthesis; total synthesis; multi-drug resistance; biological activity; anti-cancer; heterocyclic compounds; cytotoxicity; structure– activity relationship; molecular modeling
(This special issue belongs to the Section Medicinal Chemistry)
Natural Product Leads for Managing Metabolic Diseases submission deadline 30 Jun 2026 | Viewed by 110 | Submission Open
Keywords: diabetes; metabolic syndrome; metabolic diseases; natural products; mechanisms; drug discovery
(This special issue belongs to the Section Natural Products Chemistry)
Design, Synthesis, and Photochemical Studies of Functional Dyes
edited by Liang Han
submission deadline 30 Jun 2026 | Viewed by 109 | Submission Open
Keywords: synthesis of functional dyes; photochemistry of dyes; organic dyes; functional organic dyes; photo-inducing materials; organic photoelectric materials
(This special issue belongs to the Section Photochemistry)
Fluorescent Molecular Tools for Neuroscience Research
edited by Sheng Xie
submission deadline 30 Jun 2026 | Viewed by 106 | Submission Open
Keywords: histochemical method; fluorescent probes; brain-wide 3D imaging; neuropathology; immunofluorescence labeling; transgenic labeling; small-fluorophore labeling; metallophilic labeling; virus-based labeling
(This special issue belongs to the Section Cross-Field Chemistry)
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