Latest Articles for Chemistry

Scientists capture rapid molecular changes in real-time using attosecond X-ray techniques.

Explore the fascinating world of knots and their mathematical significance.

A new method integrates graph neural networks for enhanced molecular simulations.

New quantum devices enhance the study of chemical dynamics and proton transfer.

An exploration of how water acts in narrow spaces with hydrophilic surfaces.

A new technique allows detailed study of individual molecules without destruction.

Researchers are studying how light interacts with heavy atoms to reveal new chemical behaviors.

New techniques enhance efficiency in quantum computing algorithms for chemical simulations.

Investigating deuterated PAHs reveals key aspects of interstellar chemistry.

A new approach to improve molecular property predictions in AI using task addition.

Machine learning models improve predictions of molecular responses to ion irradiation.

A look at recent advancements in charge transfer research and computational methods.

A new method for improving GNNs in molecular analysis.

New studies reveal key interactions of alcohols in simplified models.

A new method improves chemical structure representation for enhanced analysis and efficiency.

Examining how surfactants affect bubble dynamics in various liquids.

A novel approach improves understanding of branched macromolecules' structures and properties.

A look into compliant graphs and their significance in various fields.

A new method simplifies feature selection in molecular simulations using graph neural networks.

A look at new methods for simplifying complex system simulations.

Explore the essential concepts of molecular physics and their practical applications.

AUGUR simplifies finding optimal spots for molecular attachment using advanced techniques.

Recent studies reveal capillary wave behavior in miscible fluids, challenging traditional fluid dynamics models.

This article examines how water influences the movement of larger molecules.

Study examines sodium ion interactions within helium nanodroplets, revealing significant insights.

Researchers investigate ion interactions with cold polar molecules for advancements in quantum science.

A new tool improves predictions for chemical reaction yields using AI.

A look into perfect matchings and the role of bricks in graph theory.

Explore a novel method for estimating the energy of diatomic molecules.

This article discusses predicting diffusion coefficients using entropy scaling and different theoretical models.

New methods improve predictions of ion interactions in water.

Study of tiny particles and their behavior in various conditions.

This article examines how molecular vibrations affect photoisomerization efficiency.

This article explores how fixed particles affect the dynamics of glass-forming materials.

CLaSMO optimizes molecule creation for health and science advancements.

Researchers develop a simplified way to create polarized attosecond pulses using mixed gases.

Iron oxide clusters show potential as catalysts for efficient hydrogen production from ammonia.

TACS helps scientists create stable molecules with desired properties.

cMBDF offers efficient and accurate modeling for chemical properties with reduced data needs.

A new method enhances prediction of molecular properties using SMILES.