Collections and calls for papers

This topical collection welcomes works focusing on in-depth analyses and discussions of complex molecular structures and interactions, offering theoretical insights and experimental methodologies to understa...

In the rapidly evolving field of molecular sciences, the integration of cutting-edge sensing technologies with artificial intelligence (AI) offers unprecedented opportunities for breakthroughs in understandi...

The aim of this topical collection is to cover the development of computational simulations and applications for various fluid and nanofluid modeling. This collection of articles will showcase the latest res...

Molecular electronics spring up as future ultimately electronic devices and have aroused multidisciplinary interests in scientific community. Over the past four decades, various techniques for fabricating na...

This topical collection aims to explore the scientific contributions in the study of quantum chemistry and its applications in constructing nanomaterials. The focus includes the investigation of electronic, ...