Search Results (1,461)

The recognition of liquid–liquid phase separation (LLPS) as a widespread organizing principle has revolutionized our view of cellular biochemistry. By forming biomolecular condensates, cells spatially orchestrate reactions without membranes. However, the dysregulation of this precise physical organization is emerging as a driver of diverse pathologies, collectively termed “Condensatopathies.” Unlike traditional proteinopathies defined by static aggregates, these disorders span a dynamic spectrum of material state dysfunctions, from the failure to assemble essential compartments to the formation of aberrant, toxic phases. While research has largely focused on neurodegeneration and cancer, the impact of condensate dysfunction likely extends across broad physiological landscapes. A central unresolved challenge lies in deciphering the “molecular grammar” that governs the transition from functional fluids to pathological solids and, critically, visualizing these transitions in situ. This “material science” perspective presents a profound conundrum for drug discovery: how to target the collective physical state of a protein ensemble rather than a fixed active site. This review navigates the evolving therapeutic horizon, examining the limitations of current pharmacological approaches in addressing the complex “condensatome.” Moving beyond inhibition, we propose that the future of intervention lies in “reverse-engineering” the biophysical codes of phase separation. We discuss how deciphering these principles enables the creation of programmable molecular tools—such as synthetic peptides and state-specific degraders—designed to precisely modulate or dismantle pathological condensates, paving the way for a new era of precision medicine governed by soft matter physics. Full article

Background: Oral insulin improves compliance and convenience in patients with diabetes who require regular needle injections. However, the clinical application of oral insulin preparations has been limited due to instability and inefficient permeation through the gastrointestinal tract. In this study, a novel cationic polysaccharide nanodrug delivery platform was designed for efficient oral insulin delivery. Methods: The innovative thiolated trimethyl chitosan-grafted β-cyclodextrin (NCT) was synthesized by utilizing N-trimethyl chitosan (TMC) as the polymer backbone. This involved modifying TMC with thiol group-containing N-acetylcysteine and carboxymethyl-β-cyclodextrin that possesses hydrophobic cavities via an amide condensation reaction. Subsequently, this polymer was employed to construct the NCT nanoparticle system using an ionic cross-linking method. The physicochemical properties of the NCT nanoparticles were systematically analyzed, and their therapeutic efficacy was comprehensively evaluated in streptozotocin (STZ)-induced animal models. Results: The NCT nanoparticles demonstrated mucus adhesion, permeability, and pH sensitivity, which facilitated a slow and controlled release within the gastrointestinal microenvironment due to both ionic electrostatic interactions and disulfide bonding interactions. The experiments revealed in vivo that insulin/NCT nanoparticles extended the retention time of insulin in the small intestine. Blood glucose levels decreased to approximately 39% of the initial level at 5 h post-administration while exhibiting smooth hypoglycemic efficacy. Simultaneously, insulin bioavailability increased to 12.58%. Conclusions: The NCT nanoparticles effectively protect insulin from degradation in the gastrointestinal microenvironment while overcoming intestinal barriers, thereby providing a promising approach to oral biomolecule delivery. Full article

High-density aviation fuels and diesel-range cycloalkanes are in high demand for the transportation sector, but the development of sustainable and high-efficiency synthesis routes from biomass-derived platform chemicals remains a key challenge. High-density aviation fuel and diesel-grade cycloalkanes were successfully synthesized from biomass-derived isophorone and furfural through a continuous process of selective hydrogenation, aldol condensation, and hydrodeoxygenation reaction. (E) 2-(Furan-2-methylene)-3,5,5-trimethylcyclohex-1-one (1A) was obtained by selective hydrogenation of isophorone to obtain 3,3,5-trimethylcyclohexanone (TMCH), which was then subjected to aldol condensation with furfural. The system studied key reaction parameters such as solvent type, temperature, catalyst type, catalyst loading, and reaction time that affect the aldol condensation of TMCH and furfural. The yield of 1A reached 98.69%, under optimized conditions using NaOH as the catalyst at a molar ratio of 3,3,5-trimethylcyclohexanone:furfural = 1:1, NaOH 0.15 g, anhydrous ethanol as the solvent, and a reaction temperature of 313 K for 1 h. A series of nickel-based catalysts supported on porous materials, including SiO₂, CeO₂, Al₂O₃, Hβ, and HZSM-5, were prepared and characterized by scanning electron microscopy (SEM) and X-ray diffraction (XRD). These catalysts were evaluated for the hydrodeoxygenation of 1A. Among them, the 10% Ni-SiO₂ catalyst exhibited the highest catalytic activity, affording a C₉–C₁₄ cycloalkane yield of 88.32% and a total carbon yield of 99.6%. This work demonstrates a promising and sustainable strategy for producing branched cycloalkanes in the diesel and jet fuel range from lignocellulosic biomass-derived platform chemicals. Full article

The anti-inflammatory scaffold 5-aminosalicylic acid, which is widely used in therapeutic applications, was chosen for the synthesis of N-[3-(hydrazinecarbonyl)-4-hydroxyphenyl]acetamide (1) to enhance its antibacterial properties. The condensation of hydrazide 1 with aromatic aldehydes provided hydrazone derivatives 2a–f, whereas cyclocondensation reactions and other related transformations afforded five-membered heterocycles, including pyrrole 3, pyrazole 4, pyrrolidinone 7, oxadiazoles 9, 10, thiadiazole 14, and triazole 15. Additional modifications yielded acetylhydrazine derivative 11, which was O-alkylated to analogue 12. Antibacterial evaluation showed stronger activity against Gram-positive bacteria such as S. aureus and MRSA than against Gram-negative strains of E. coli and S. Enteritidis, consistent with differences in cell membrane permeability. Notably, derivatives containing pyrrolidinone 7, thiosemicarbazide 13, and 1,3,4-thiadiazole 14 exhibited potent bactericidal activity against S. aureus and MRSA, while hydrazones 2b, 2c, 2f, pyrrole 3, and pyrrolidinone 7 exhibited activity against E. coli. These results provide a practical strategy for the discovery of heterocyclic compounds and emphasise the potential of functionalised 5-aminosalicylic acid derivatives as prime candidates for the development of broad-spectrum antibacterial agents. Full article

Sewage sludge was pyrolyzed at mass rate of 500 g/h in a bench-scale rotary kiln for methane-rich syngas production. The tested process variables were the pyrolysis temperature (600, 700 and 800 °C) and the CaO addition to the process (0 and 0.2 CaO/dried sewage sludge). Product distribution (char, condensable product, and gas) as well as their chemical composition were determined. At CaO/dried sewage sludge mass ratio equal to 0, with the increasing pyrolysis temperature from 600 to 800 °C, the gas yield increased from 31.4% to 45.6 wt.%, while the char yield decreased from 41.3 to 37.5 wt.%. At CaO/dried sewage sludge mass ratio equal to 0.2, significantly different product distribution and chemical composition were detected. In fact, syngas showed a net CO₂ concentration reduction (under 10 mol %), while methane concentration increased at 600 and 700 °C up to 54 and 42 mol %, respectively. The total gas yield increased, probably because of the CaO behavior as catalyst of volatiles conversion reactions (cracking and reforming). In fact, the condensable product yield decreased up to 7 wt.% at 800 °C. At CaO/dried sewage sludge equal to 0.2 and pyrolysis temperature of 700 °C, the maximum methane yield of 150 g/kg _SS was detected. Full article

This study investigates the energy performance and preliminary turbomachinery design of post-combustion CO₂ compression systems integrated into an ultra-supercritical coal-fired power plant with carbon capture and storage (CCS). To enable pipeline transport, CO₂ must be delivered at 150 bar and 15 °C, i.e., in liquid phase. Unlike conventional configurations that compress CO₂ entirely in the gaseous/supercritical phase before final cooling, two alternative layouts are proposed, introducing an intermediate liquefaction step prior to liquid-phase compression. Each layout uses a chiller system that operates at CO₂ condensation temperatures of 10 °C and 20 °C. The energy performance and the system layout architecture are evaluated and compared with the conventional gaseous-phase compression configuration. An in-depth sensitivity analysis, which varies the flow coefficient, the working coefficient, and the degree of reaction, confirms that the turbomachinery preliminary design, based on input parameters related to the specific speed, is a high-efficiency design. The results indicate that the 10 °C liquefaction layout requires the least compression power (60 MW), followed by the 20 °C layout (62.5 MW) and the conventional system (67 MW). Including the consumption of the chiller, the proposed systems require an additional power of 11–12 MW, compared to just over 1 MW for the conventional layout with simple CO₂ cooling. These results highlight the significant influence of the integration of the chiller on the overall power requirement of the system. Although the proposed configurations result in a larger equipment footprint, the integrated capture and compression/liquefaction system allows for very low CO₂ emissions, making the power plant more sustainable. Full article

A novel unsymmetrical azine, 6-((2-oxoindolin-3-ylidene)hydrazineylidene)indolo[2,1-b]quinazolin-12(6H)-one, was synthesized through a condensation reaction between tryptanthrin-6-hydrazone and isatin in chloroform under reflux conditions. Structural characterization revealed the compound exists as a mixture of geometric isomers with one predominant form. Density functional theory (DFT) calculations identified the E,E configuration as the most stable isomer. The isomerization barriers for both C=N bonds were calculated at approximately 18.5 kcal/mol via nitrogen inversion. Given the established biological activities of tryptanthrin and isatin derivatives, this hybrid azine represents a promising lead compound for developing bifunctional drug candidates. Full article

The Kabachnik–Fields (KF) reaction is a versatile three-component method for the condensation of amines, carbonyl compounds, and P–H reagents, enabling efficient synthesis of α-aminophosphonates—key bioactive and functional molecules. This review critically examines the literature from the last 25 years. However, with regard to mechanistic aspects, selected earlier seminal studies are also considered when necessary to provide a coherent and comprehensive mechanistic framework. Advances in catalyst-free methodologies, sustainable synthetic approaches, and Lewis and Brønsted acid catalysis are discussed, alongside developments in enantioselective KF reactions in the presence of chiral metal complexes or organocatalysts. Full article

Methoxy radicals (CH₃O•), formed as intermediates during methane oxidation, may play an underexplored but locally significant role in the atmospheric oxidation of dimethyl sulfide (DMS), a key sulfur-containing compound emitted primarily by marine phytoplankton. This study presents a comprehensive computational investigation of the reaction mechanisms and kinetics of DMS oxidation initiated by CH₃O•, using density functional theory B3LYP-D3(BJ)/6-311++G(3df,3pd), CCSD(T)/6-311++G(3df,3pd), and UCBS-QB3 methods. Our calculations show that DMS reacts with CH₃O• via hydrogen atom abstraction to form the methyl-thiomethylene radical (CH₃SCH₂•), with a rate constant of 3.05 × 10⁻¹⁶ cm³/molecule/s and a Gibbs free energy barrier of 14.2 kcal/mol, which is higher than the corresponding barrier for reaction with hydroxyl radicals (9.1 kcal/mol). Although less favorable kinetically, the presence of CH₃O• in localized, methane-rich environments may still allow it to contribute meaningfully to DMS oxidation under specific atmospheric conditions. While the short atmospheric lifetime of CH₃O• limits its global impact on large-scale atmospheric sulfur cycling, in marine layers where methane and DMS emissions overlap, CH₃O• may play a meaningful role in forming sulfur dioxide and downstream sulfate aerosols. These secondary organic aerosols lead to cloud condensation nuclei (CCN) formation, subsequent changes in cloud properties, and can thereby influence local radiative forcing. The study’s findings underscore the importance of incorporating CH₃O• driven oxidation pathways into atmospheric models to enhance our understanding of regional sulfur cycling and its impacts on local air quality, cloud properties and radiative forcing. These findings provide mechanistic insights that improve data interpretation for atmospheric models and extend predictions of localized variations in sulfur oxidation, aerosol formation, and radiative forcing in methane-rich environments. Full article

The structure and properties of coke are of significant importance in the metallurgical industry. Coke samples were prepared from different bituminous coals at varying temperatures using a one-sided heating furnace. The evolution of carbon structure during the coking process was investigated by X-ray diffraction (XRD) and Raman spectroscopy. The correlations between carbon structure parameters and the properties of the coal and coke were investigated during coke formation. The results indicated that with increasing temperature, the values of L_a, L_c, N, n, and f_a were increased, while the d₀₀₂ values decreased. The L_a/L_c ratio was expanded twice more than raw coal due to condensation and cross-linking reactions, indicating compaction of the carbon structure and the formation of larger aromatic units. A negative correlation was observed between L_c and the Coke Reactivity Index (CRI), whereas a positive correlation was found between L_a and Coke Strength after Reaction (CSR), which mean that coke properties improve with increasing L_c. Specifically, when L_c exceeds 2.4 nm, and L_a lies between 5 and 5.5 nm, the coke exhibits higher quality. The quality of coke is strongly affected by the structural evolution of carbon during the coal coking process. Full article

The ruthenium-catalysed silylative coupling (SC) reaction is a useful method for obtaining selectively functionalised organosilicon compounds, which have a wide range of applications in organometallic and organic chemistry. It is possible to prepare such compounds with norbornene matrices, which can be used for ring-opening metathesis polymerisation (ROMP) in the synthesis of linear-type polymers. Herein, we present a method for the synthesis of the aforementioned matrices by a condensation reaction between diol and vinylphenylboronic acids. Furthermore, these compounds were subsequently modified by SC reaction and polymerised by ROMP. To assess the possibility of using styryl-based silyl-derived monomers as building blocks in further organic transformations, the process of bromodesilylation was also investigated. We would also like to perform a comparative study on the selectivity of hydrosilylation and silylative coupling processes in the case of discovered materials. Full article

Development of new biologically active materials based on natural products has, over the years, attracted considerable attention due to their effectiveness in human health and disease. Polyphenolic compounds, particularly flavonoids, provide a wide range of health benefits, including antioxidant, anti-inflammatory, anticancer, and antibacterial properties. A series of novel Schiff base derivatives of flavonoids with amino-containing linkers was successfully designed and synthesized through condensation reactions. Naringin and naringenin derivatives with diamines, including ethylenediamine (EDA), 1,3-diamino-2-propanol (DA-2-PrOH), tetramethylenediamine (TMEDA), pentamethylenediamine (PMEDA), as well as polyamines spermidine (SPD) and spermine (SPM), were synthesized and well-characterized through FT-IR, UV–Visible, ESI–MS, ¹H and ¹³C NMR spectroscopy, and elemental analysis. The so confirmed and well-characterized derivatives were subjected to photoluminescence studies, exhibiting enhanced activity, especially for naringin-based derivatives, and quenching in some others, thus verifying the significance of chemically modifying the conjugated systems of these molecules. Their biological activity was examined in the case of their antimicrobial efficacy against two Gram (+) (Staphylococcus aureus and Bacillus cereus) and two Gram (−) (Escherichia coli and Xanthomonas campestris) bacterial strains. Antibacterial screening projected selectivity of modified flavonoids against E. coli, proposing new “dense” flavonoid-(poly)amine materials as multifunctional antimicrobial agents and fluorescent probes. Full article

Reaction conditions (RCs) are a crucial part of reaction definition, and their accurate prediction is an important component of chemical synthesis planning. The existence of multiple combinations of RCs capable of achieving the desired result complicates the task of condition recommendation. Herein, we propose a conditional variational autoencoder (CVAE) generative model to predict suitable RCs. The CVAE model has been customized to generate diverse sets of valid conditions, ensuring high flexibility and accuracy, while circumventing the necessity for enumeration or combinatorial search of potential RCs. The efficacy of the CVAE approaches was evaluated using hydrogenation reactions and other H₂-mediated reactions, predicting the set of catalysts, additives (acid, base, and catalytic poison), ranges of temperature, and pressure. The CVAE models predicted conditions with different “heads”, each corresponding to specific condition components, and their respective losses. CVAE models were tested on two datasets: a small one containing 31K reactions with 2232 potential conditions’ combinations and a big one having 196K reactions with ~7 × 10⁴² potential conditions’ combinations to evaluate the model’s ability to predict varying complexity and diversity conditions. To optimize the accuracy of the models, we experimented with three latent distribution variants—Gaussian (g-CVAE), Riemannian Normalizing Flow (rnf-CVAE), and Hyperspherical Uniform (h-CVAE). In our experiments, the h-CVAE model demonstrated robust overall performance, making it the optimal choice for scenarios requiring high accuracy across multiple top-k predictions. Benchmarking analyses demonstrated the high performance of the CVAE models compared to state-of-the-art reaction condition prediction approaches. Full article

This review explores the pervasive role of water in generating, storing, and mediating electric charge across natural and artificial systems. Far from being a passive medium, water actively participates in electrostatic and electrochemical processes through its intrinsic ionization, interfacial polarization, and charge separation mechanisms. The Maxwell–Wagner–Sillars (MWS) effect is presented as a unifying framework explaining charge accumulation at air–water, water–ice, and water–solid interfaces, forming dynamic “electric mosaics” across Earth’s environments. The authors integrate diverse phenomena—triboelectricity, hygroelectricity, hydrovoltaic effects, elastoelectricity, and electric-field-driven phase transitions—showing that ambient water continually shapes the planet’s electrical landscape. Electrostatic shielding by humid air and hydrated materials is described, as well as the spontaneous electrification of sliding or dripping water droplets, revealing new pathways for clean energy generation. In addition, the review highlights how electric fields and interfacial charges alter condensation, freezing, and chemical reactivity, underpinning discoveries such as microdroplet chemistry, “on-water” reactions, and spontaneous redox processes producing hydrogen and hydrogen peroxide. Altogether, the paper frames water as a universal electrochemical medium whose interfacial electric imprint influences atmospheric, geological, and biological phenomena while offering novel routes for sustainable technologies based on ambient charge dynamics and water-mediated electrification. Full article

The synthesis of biocidal peptide materials using simple, low-cost, solvent-free methods is a crucial challenge for developing new antimicrobial approaches. In this study, we produced proteinoid nanostructures through simple, inexpensive, and environmentally friendly thermal reactions between glutamic acid (Glu) and tyrosine (Tyr) in various molar ratios. Mechanistically, the thermal cyclization of glutamic acid into pyroglutamic acid (pGlu) facilitated the formation of short peptide chains containing pGlu as the N-terminus moiety and subsequent L-tyrosine or glutamic acid residues, which self-assembled into nanometric spheroidal structures that exhibit blue emission. Spectroscopic (FTIR, UV-Vis, photoluminescence) and mass (LC-MS) analyses confirmed the formation of mixed pGlu-/Tyr/Glu peptides. All products exhibit dose-dependent antimicrobial activity against Methicillin-Resistant Staphylococcus aureus (MRSA), with a minimum inhibitory concentration (MIC) of 25 mg mL⁻¹ for the GluTyr 1:1 and 2:1 proteinoids. The outcomes observed following 24 h exposure of the HEK293 cell line to the materials indicate their suitability for integration into hybrid systems for antimicrobial surfaces. This work is the first to demonstrate a direct antibacterial activity of proteinoids obtained by thermal condensation, opening up the possibility of designing a new class of synthetic antimicrobial peptides. Full article