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Abstract This study presents the synthesis, characterization, and application of silanized nano-biochar (SNB) derived from palm kernel shell for the development of high-performance low-density polyethylene (LDPE) composi...

A novel and cost-effective synthesis of silicon nanocrystallites (

Abstract In this study, graphitic carbon nitride, often known as g-C₃N₄, has also been shown to be a highly attractive photocatalyst that works well with visible light. However, its performance has been adversely aff...

Abstract The present study employed a three-step synthetic strategy to develop a series of novel (Z)-N-(2,4-dimethylphenyl)-3-(3-(((5-phenyl-1,3,4-thiadiazol-2-yl) imino) methyl)-1H-indol-1-yl) propanamide derivatives. T...

Abstract Direct hydrogenation of CO2 with renewable H2 into value-added chemicals provides a promising pathway for sustainable carbon utilization in the future. Although extensive research has been conducted on CO2 hydro...

Rechargeable all-solid-state batteries (ASSBs) are considered as promising candidates for next-generation energy storage due to their high energy density and excellent safety performance. However, the low ionic conductiv...

Abstract Antibiotic residues in aquatic systems accelerate antimicrobial resistance and require efficient solar-driven advanced oxidation strategies. Herein, we engineer an oxygen-vacancy-rich La-doped NiFe₂O₄ spinel...

ABSTRACT Tetracycline (TC) is a commonly prescribed broad‐spectrum antibiotic, and its widespread use together with its persistence in biological matrices, particularly urine, has raised serious concerns related to cli...

Eco-friendly approaches for nanoparticle synthesis have gained attention due to their sustainability and reduced environmental impact. Zinc oxide nanoparticles (ZnO NPs) exhibit versatile bioactivities, but conventional ...

We are reporting two new mixed valent Co(ii)/Co(iii) polynuclear complexes, {Co II 6 Co III 3 } and {Co II Co III 4 }, bearing different amount of Co(ii) ions in their cores, through the employment of the multidentate tr...

The relentless pursuit of athletic excellence is shadowed by the equally persistent evolution of performance-enhancing drugs (PEDs). In recent years, the antidoping landscape has been profoundly shaped by the rise of two...

There is a wealth of structural data on peptides that bind potential drug targets, serving as rich inspiration for designing small molecule inhibitors which can recapitulate key binding interactions while improving pharm...

Part 1 Introduction - preliminary demarcation of a type of Bourgeois Public Sphere: the initial question remarks on the type representative publicness on the genesis of the Bourgois Public Sphere. Part 2 Social structure...

Materias / palabras clave: Bacteriophage; Cleavage (geology); Gel electrophoresis; Chemistry; Head (geology); Gene; Biology; Biochemistry; Computational biology; Escherichia coli; Paleontology; Fracture (geology)

The Cambridge Structural Database (CSD) contains a complete record of all published organic and metal-organic small-molecule crystal structures. The database has been in operation for over 50 years and continues to be th...

The improvements in the crystal structure refinement program SHELXL have been closely coupled with the development and increasing importance of the CIF (Crystallographic Information Framework) format for validating and a...

Abstract This study focuses on burnout and its positive antipode—engagement. A model is tested in which burnout and engagement have different predictors and different possible consequences. Structural equation modeling...

We describe the development, current features, and some directions for future development of the Amber package of computer programs. This package evolved from a program that was constructed in the late 1970s to do Assist...

Materias / palabras clave: Cynicism; Psychology; Burnout; Work engagement; Confirmatory factor analysis; Structural equation modeling; Social psychology; Emotional exhaustion; Clinical psychology; Statistics; Chemistry; Mathematics

The program Mercury , developed by the Cambridge Crystallographic Data Centre, is designed primarily as a crystal structure visualization tool. A new module of functionality has been produced, called the Materials Module...

This paper describes various components of the macromolecular crystallographic refinement program REFMAC5, which is distributed as part of the CCP4 suite. REFMAC5 utilizes different likelihood functions depending on the ...

Abstract CHARMM ( C hemistry at HAR vard M acromolecular M echanics) is a highly flexible computer program which uses empirical energy functions to model macromolecular systems. The program can read or model build struct...

New protein parameters are reported for the all-atom empirical energy function in the CHARMM program. The parameter evaluation was based on a self-consistent approach designed to achieve a balance between the internal (b...

A novel and robust automated docking method that predicts the bound conformations of flexible ligands to macromolecular targets has been developed and tested, in combination with a new scoring function that estimates the...