Analytical chemistry researchers at the University of Amsterdam's Van 't Hoff Institute for Molecular Sciences (HIMS) have ...

More information: Daniil A. Boiko et al, Advancing molecular machine learning representations with stereoelectronics-infused molecular graphs, Nature Machine Intelligence (2025).

Calzaferri, G., Forss, L. and Kamber, I. (1989) Molecular Geometries by the Extended Hueckel Molecular Orbital (EHMO) Method. The Journal of Physical Chemistry, 93 ...

Just a few weeks after conception, stem cells are already orchestrating the future structure of the human brain. A new Yale-led study shows that, early in development, molecular “traffic cops” known ...

Understanding the Lewis structure and other properties of CO 2 is is an essential part of chemistry, providing insights into molecular bonding, geometry, and behaviour of the carbon dioxide molecule.

Molecular Geometry: Get to know what molecular geometry is and its types. Students check the postulates of the Valence Shell Electron Pair Repulsion (VSEPR) Theory.

The ability of CO2 to absorb infrared radiation is directly tied to its molecular geometry. This characteristic is pivotal in Earth's energy balance and is a focus of climate modeling.

Accurate molecular representation plays a crucial role in expediting the process of drug discovery. Graph neural networks (GNNs) have demonstrated robust capabilities in molecular representation ...

The cosmos may have something in common with a doughnut. In addition to their fried, sugary goodness, doughnuts are known for their shape, or in mathematical terms, their topology. In a universe ...

Molecular geometry modeling is a powerful tool for understanding the intricate relationships between molecular structure and biological activity – a field known as structure-activity relationships ...