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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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Bioactive Compounds from Traditional Medicinal Plants: Extraction, Identification, and Health Implications submission deadline 31 Jul 2025 | 2 articles | Viewed by 2288 | Submission Open
Keywords: bioactive compounds; polyphenols; secondary metabolites; traditional medicinal plants; extraction; green chemistry; characterization; health implications
(This special issue belongs to the Section Natural Products Chemistry)
An Insight into Medicinal Chemistry of Anticancer Drugs
edited by Gabriela Figueroa-González and
submission deadline 31 Jul 2025 | 1 articles | Viewed by 2197 | Submission Open
Keywords: natural products; anticancer; synthesis; drug resistance; multitargeted therapy
(This special issue belongs to the Section Medicinal Chemistry)
Macrocyclic Cage Molecules and Substances of Chemical/Pharmacological Interest
edited by
submission deadline 31 Jul 2025 | 1 articles | Viewed by 2130 | Submission Open
Keywords: macrocyclic cage molecules; cyclodextrins; bambusurils; calixarenes; DFT/ab initio calculations; molecular dynamics simulations; drug delivery
(This special issue belongs to the Section Computational and Theoretical Chemistry)
Bee Products: Recent Progress in Health Benefits Studies, 2nd Edition submission deadline 31 Jul 2025 | 1 articles | Viewed by 2029 | Submission Open
Keywords: honey bee products; bioactive compounds; biological and phamacological activity; health benefits; side effects of honey bee products
(This special issue belongs to the Section Natural Products Chemistry)
Computational Study of Planar Clusters and Materials
edited by
submission deadline 31 Jul 2025 | 1 articles | Viewed by 1864 | Submission Open
Keywords: planar cluster; chemical bonding; planar material; aromaticity; stability; adsorptive property
(This special issue belongs to the Section Computational and Theoretical Chemistry)
Functional Porous Frameworks: Synthesis, Properties, and Applications
edited by
submission deadline 31 Jul 2025 | 2 articles | Viewed by 1677 | Submission Open
Keywords: metal– organic frameworks; covalent organic frameworks; mesoporous silica; periodic mesoporous organosilicas; catalysis; biomedical applications; energy storage; environmental remediation
(This special issue belongs to the Section Materials Chemistry)
Synthesis of Natural Products Using Engineered Plants and Microorganisms, 2nd Edition submission deadline 31 Jul 2025 | 1 articles | Viewed by 1612 | Submission Open
Keywords: natural products; bioactive molecules; medicinal herbs; metabolic engineering; microbial cell factories; synthetic biology; natural product biosynthetic pathway; omics technologies; large-scale production pathway optimization
(This special issue belongs to the Section Natural Products Chemistry)
Bioactive Molecules in Medicinal Plants submission deadline 31 Jul 2025 | 1 articles | Viewed by 1532 | Submission Open
Keywords: bioactive compounds; identification and isolation of compounds; bioactivity of secondary metabolites; medicinal plants
(This special issue belongs to the Section Medicinal Chemistry)
New Advances in Deep Eutectic Solvents, 2nd Edition
edited by and Elisabete Ferreira
submission deadline 31 Jul 2025 | 1 articles | Viewed by 1499 | Submission Open
Keywords: green chemistry; natural compounds; sustainable processes; solvents; electrolytes; extraction
(This special issue belongs to the Section Green Chemistry)
Synthesis, Identification and Biological Evaluation of Novel Natural and Derivative Products
edited by
submission deadline 31 Jul 2025 | 1 articles | Viewed by 1475 | Submission Open
Keywords: organic synthesis; natural products; theoretical calculation; DFT; structure identification; biological evaluation
(This special issue belongs to the Section Natural Products Chemistry)
Review Papers in Analytical Chemistry, 2nd Edition
edited by
submission deadline 31 Jul 2025 | 2 articles | Viewed by 1416 | Submission Open
Keywords: analytical chemistry; analytical spectroscopy; environmental sciences; medical science; forensic science; cultural heritage; food analysis
(This special issue belongs to the Section Analytical Chemistry)
Advanced Research in Macromolecular Crystallography
edited by Wu-Pei Su and
submission deadline 31 Jul 2025 | 1 articles | Viewed by 1393 | Submission Open
Keywords: direct phasing methods; X-ray crystallography; protein structural determination; image reconstruction from Fourier amplitudes; iterative projection algorithm
(This special issue belongs to the Section Chemical Biology)
Progress and Challenges in Organic Optoelectronic Functional Materials
edited by Hongli Liu
submission deadline 31 Jul 2025 | 1 articles | Viewed by 1268 | Submission Open
Keywords: organic photoelectric materials; photoelectric device; small-molecule luminous materials; photoelectric conversion materials; dyes and pigments; organic electroluminescent materials; fluorescent probe; organic synthesis
(This special issue belongs to the Section Cross-Field Chemistry)
Heterogeneous Catalysis: Recent Advances and Future Perspectives
edited by Agata Łamacz
submission deadline 31 Jul 2025 | 1 articles | Viewed by 1267 | Submission Open
Keywords: heterogeneous catalysis; bifunctional catalysts; catalyst design; synthesis methods; catalytic processes
Porous Carbons for Gas Adsorption and Capture
edited by
submission deadline 31 Jul 2025 | 1 articles | Viewed by 1248 | Submission Open
Keywords: porous carbons; gas adsorption; gas capture; carbon sequestration; surface chemistry; material synthesis
(This special issue belongs to the Section Applied Chemistry)
Renewable Energy, Fuels and Chemicals from Biomass, 2nd Edition
edited by and
submission deadline 31 Jul 2025 | 2 articles | Viewed by 1221 | Submission Open
Keywords: biomass conversion technologies; renewable energy; biofuel synthesis; catalytic biomass transformation; bioethanol; biodiesel; green/sustainable chemistry; biotechnological applications
(This special issue belongs to the Section Applied Chemistry)
Functional Nanomaterials for Environmental Remediation and Ecotoxicity Assessment submission deadline 31 Jul 2025 | 1 articles | Viewed by 1181 | Submission Open
Keywords: nanomaterials; environmental remediation; sensing; ecotoxicity; synthesis; photocatalysis; semiconductor; magnetic; optical
(This special issue belongs to the Section Nanochemistry)
Organic Molecules in Drug Discovery and Development
edited by
submission deadline 31 Jul 2025 | 2 articles | Viewed by 1129 | Submission Open
Keywords: organic chemistry; chemical synthesis; chemical modifications; organic molecules; molecular mechanisms; bioactivity; drug development; drugs
(This special issue belongs to the Section Medicinal Chemistry)
Porous Carbons for CO2 Adsorption and Capture
edited by and Jinsong Shi
submission deadline 31 Jul 2025 | 2 articles | Viewed by 1076 | Submission Open
Keywords: porous carbons; carbon nanotubes; graphene oxide; carbon nanomaterials; activated carbons; adsorbents; CO2 adsorption; CO2 capture; physisorption; chemical activation; physical activation; surface functionalization; pore structure design; carbon doping; nitrogen doping; CO2 capture efficiency; CO2 selectivity; direct air capture (DAC); CO2 storage; industrial CO2 capture; carbon capture and utilization (CCU); CO2 adsorption mechanisms; adsorption kinetics; sustainable materials; adsorbent regeneration; machine learning in material design
(This special issue belongs to the Section Materials Chemistry)
The Anticancer Drugs: A New Perspective
edited by and
submission deadline 31 Jul 2025 | 1 articles | Viewed by 1025 | Submission Open
Keywords: anticancer therapy; targeted therapy; drug design; drug discovery; drug synthesis; nanotechnology
(This special issue belongs to the Section Medicinal Chemistry)
Design, Modifications, and Medical Application of Polymer-Based Materials
edited by
submission deadline 31 Jul 2025 | 2 articles | Viewed by 825 | Submission Open
Keywords: polymer-based materials; synthetic polymers; drug delivery systems; biocompatibility; biomaterials; tissue engineering; wound healing; medical devices
(This special issue belongs to the Section Materials Chemistry)
BODIPYs: State of the Art and Future Perspectives submission deadline 31 Jul 2025 | 2 articles | Viewed by 763 | Submission Open
Keywords: BODIPYs; spectroscopy; synthesis; quantum mechanics; tunable laser; bioimaging; photodynamic therapy; optoelectronics
(This special issue belongs to the Section Colorants)
Volatile Natural Products: Extraction, Characterization and Application
edited by
submission deadline 31 Jul 2025 | 2 articles | Viewed by 761 | Submission Open
Keywords: volatile components; aroma; essential oil; extraction methods; gas chromatography; gas chromatography– mass spectrometry; natural products
(This special issue belongs to the Section Natural Products Chemistry)
Natural Bioactive Compounds: Therapeutic Potential in the Management of Chronic Diseases submission deadline 31 Jul 2025 | 1 articles | Viewed by 714 | Submission Open
Keywords: natural bioactives; phytochemicals; polyphenols; isoprenoids; alkaloids; bioactive lipids and peptides; prebiotics; postbiotics; chronic diseases; non-communicable diseases
(This special issue belongs to the Section Natural Products Chemistry)
Advances in Gel Materials: Synthesis, Characterization and Applications
edited by Nina Danchova and
submission deadline 31 Jul 2025 | Viewed by 646 | Submission Open
Keywords: advanced gels; aerogels; hybrid gels; composites; selective sorbents; energy storage; environmental protection; optical materials
(This special issue belongs to the Section Cross-Field Chemistry)
Exclusive Papers of Editorial Board Members and Invited Scholars in “Materials Chemistry”, 2nd Edition
edited by
submission deadline 31 Jul 2025 | 2 articles | Viewed by 638 | Submission Open
Keywords: biomaterials; nanomaterials; hybrid materials; core-shell materials; thin films; self-assembling systems; hydrogels; sensors and biosensors
(This special issue belongs to the Section Materials Chemistry)
Recent Advances in Flame Retardant Polymeric Materials, 2nd Edition
edited by
submission deadline 31 Jul 2025 | 1 articles | Viewed by 631 | Submission Open
Keywords: polymeric materials; flame retardants; synthesis; multifunctionality; mechanisms; nanocomposites
(This special issue belongs to the Section Materials Chemistry)
Water Electrolysis
edited by Linjing Yang
submission deadline 31 Jul 2025 | 1 articles | Viewed by 596 | Submission Open
Keywords: electrocatalysts; hydrogen production; water splitting
(This special issue belongs to the Section Electrochemistry)
Computational Study and Molecular Modeling in Materials Chemistry
edited by , and Kerry Wrighton-Araneda
submission deadline 31 Jul 2025 | 1 articles | Viewed by 544 | Submission Open
Keywords: computational materials; materials design; molecular modeling; quantum mechanical calculations; molecular dynamics simulations; molecular properties; molecular interactions
(This special issue belongs to the Section Materials Chemistry)
Cellulose Materials: Present and Future
edited by
submission deadline 31 Jul 2025 | Viewed by 379 | Submission Open
Keywords: cellulose; cellulose nanocrystals; sustainability; green chemistry; surface functionalization; cellulose derivatives; nanocomposites
(This special issue belongs to the Section Materials Chemistry)
Graphene-Based Materials for Supercapacitor Applications
edited by Ursel Bangert
submission deadline 31 Jul 2025 | Viewed by 371 | Submission Open
Keywords: graphene; two-dimensional materials; supercapacitors; fabrication of graphene-based supercapacitors; characterization methods; supercapacitor device characterization; device functionality and operation monitoring; applications; advantages
(This special issue belongs to the Section Materials Chemistry)
New Advances in the Use of Nanoparticles as Antimicrobial Drug Carriers submission deadline 31 Jul 2025 | Viewed by 352 | Submission Open
Keywords: essential oils; plant extracts; anti-infective agents; antimicrobial activity; nanoparticles; biofilm
(This special issue belongs to the Section Nanochemistry)
Secondary Metabolites of Natural Origin as the Bioactive Resources
edited by
submission deadline 31 Jul 2025 | Viewed by 329 | Submission Open
Keywords: secondary metabolites; bioactive compounds; phytochemicals; drug discovery
(This special issue belongs to the Section Food Chemistry)
Synthesis of Bioactive Compounds: Spectroscopic, Crystallographic and Computational Studies
edited by and Diana Becerra Córdoba
submission deadline 31 Jul 2025 | Viewed by 326 | Submission Open
Keywords: medicinal chemistry; organic chemistry; analytical chemistry; heterocyclic compounds; spectroscopic analysis; crystal structure; biological activity; computational analyses
(This special issue belongs to the Section Medicinal Chemistry)
Natural Products: From Isolation and Identification to Biological Activity—4th Edition
edited by
submission deadline 31 Jul 2025 | Viewed by 309 | Submission Open
Keywords: ethnobotany; biological activity; antioxidants; phytochemical characterization; plant secondary metabolites
(This special issue belongs to the Section Natural Products Chemistry)
Molecular Docking in Drug Discovery, 2nd Edition
edited by
submission deadline 31 Jul 2025 | Viewed by 304 | Submission Open
Keywords: computer aided drug design; drug discovery; molecular docking; structure– activity relationships; drug design
(This special issue belongs to the Section Medicinal Chemistry)
Vitrimers and Sustainable Polymers: Pioneering Recycling and Controlled Degradation
edited by and Marc Guerre
submission deadline 31 Jul 2025 | Viewed by 297 | Submission Open
Keywords: vitrimers; polymer recycling; debonding technologies; circular economy; controlled biodegradation; sustainable polymers; environmental impact
(This special issue belongs to the Section Macromolecular Chemistry)
Phytochemical Alterations Induced by Food Processing and Food Supplement Processing
edited by Özlem Tokuşoĝlu and
submission deadline 31 Jul 2025 | Viewed by 295 | Submission Open
Keywords: phytochemicals; phytochemical alterations; food bioactives; plant bioactives; reaction mechanisms; food supplements; food supplement processing
(This special issue belongs to the Section Food Chemistry)
Biocatalytic Platforms Towards Synthesis and Degradation Processes submission deadline 31 Jul 2025 | 1 articles | Viewed by 274 | Submission Open
Keywords: biotechnology; bioconversions; biodegradations; green chemistry
(This special issue belongs to the Section Bioorganic Chemistry)
Peptides and Peptide Mimetics: Design, Synthesis, and Applications
edited by
submission deadline 31 Jul 2025 | Viewed by 264 | Submission Open
Keywords: peptide design; peptide mimetics; bioactive peptides; peptide synthesis; therapeutic peptides; drug delivery systems; peptide-based biotechnology; structure– activity relationship (SAR); computational peptide modeling; peptoids and foldamers
(This special issue belongs to the Section Cross-Field Chemistry)
Research Progress of Antioxidant Compounds in Foods and Beverages
edited by and
submission deadline 31 Jul 2025 | Viewed by 251 | Submission Open
Keywords: chemical compounds; identification; process development; foods; beverages
(This special issue belongs to the Section Food Chemistry)
Advances in the Applications of Surface Enhanced Raman Scattering, 2nd Edition submission deadline 31 Jul 2025 | Viewed by 249 | Submission Open
Keywords: surface-enhanced Raman scattering; enhancement; applications; nanoparticles; plasmons
(This special issue belongs to the Section Analytical Chemistry)
Chemistry and Health: Nitrogen Heterocycle Chemistry and Medicinal Chemistry, 2nd Edition
edited by
submission deadline 31 Jul 2025 | Viewed by 209 | Submission Open
Keywords: heterocycles; azines; azoles; anticancer; anti-tuberculosis; antimicrobial; growth factors
(This special issue belongs to the Section Medicinal Chemistry)
Synthesis and Characterization of Peripherally Functionalized Porphyrazines and Phthalocyanines submission deadline 31 Jul 2025 | Viewed by 196 | Submission Open
Keywords: porphyrazine; phthalocyanine; organic synthesis; photodynamic therapy; photodynamic inactivation; photocatalysis; photodegradation; electrocatalysis
(This special issue belongs to the Section Organic Chemistry)
Design, Synthesis, and Application of Zeolite Materials
edited by Chengyi Dai, Junjie Li, Jiaxing Zhang and Qingrun Meng
submission deadline 31 Jul 2025 | Viewed by 186 | Submission Open
Keywords: zeolite design; synthetic methodologies; catalytic applications; structure– activity relationships; zeolite nanoscale engineering; interdisciplinary applications; diffusion; selectivity
(This special issue belongs to the Section Applied Chemistry)
Small-Molecule Drug Design and Discovery
edited by Qiuqin He
submission deadline 31 Jul 2025 | Viewed by 138 | Submission Open
Keywords: small-molecule drug design; structure-based drug design; fragment-based drug discovery; PROTAC technology; artificial intelligence technology; biological evaluation
(This special issue belongs to the Section Medicinal Chemistry)
Artificial Intelligence Driving Transformative Advances in Food Science and Technology submission deadline 31 Jul 2025 | Viewed by 137 | Submission Open
Keywords: food sustainability; artificial intelligence; food processes optimization; functional foods; food safety; individualized nutrition
(This special issue belongs to the Section Food Chemistry)
Corrosion Electrochemistry: A Themed Issue in Honor of the Many Contributions of Prof. Dr. Changjian Lin
edited by Jiming Hu and Guozhe Meng
submission deadline 31 Jul 2025 | Viewed by 136 | Submission Open
Keywords: corrosion electrochemistry; corrosion and protection; anti-corrosion coatings; electrochemical test
(This special issue belongs to the Section Electrochemistry)
Determination of Trace Heavy Metals and Metalloids in Environmental and Food Samples, 3rd Edition submission deadline 31 Jul 2025 | Viewed by 121 | Submission Open
Keywords: environmental analytical chemistry; food analytical methods; trace heavy metals and metalloids; chemical speciation; instrumental analysis; new analytical methods and techniques; sample pre-treatment; extreme environments; reviews; emerging environmental issues; emerging food issues; food and “ novel foods” ; insects; climate change and biogeochemical cycles of trace heavy metal(loid)s
(This special issue belongs to the Section Analytical Chemistry)
Biomolecules Interactions with Nanoparticles submission deadline 31 Jul 2025 | Viewed by 119 | Submission Open
Keywords: nanoparticles; biomolecules; drugs; drug– nanoparticle conjugates; adsorption processes; proteins; lipids; biological processes
(This special issue belongs to the Section Applied Chemistry)
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