Quantum chemical methods underpin the accurate description of molecular structure and dynamics by solving the electronic Schrödinger equation within controlled approximations. Ab initio approaches ...

Researchers from Heinrich Heine University Düsseldorf (HHU) have taken an important step toward developing intelligent ...

OverviewProteins are not static molecular objects but dynamic conformational ensembles whose structures, motions, disorder, ...

A team of researchers has uncovered a previously unknown phenomenon that could improve the way we design materials at the molecular level. By unlocking a transformation between two types of structural ...

Ultrasound can open and rebuild molecular nanocages, enabling controlled release of cancer drugs and advancing targeted drug ...