Archive for December 2021

InteraQt: Fully Automated Quantum Chemical Supramolecular Chemistry

To the extent that molecular (al)chemistry* has evolved into an applied science the next frontier has become supramolecular chemistry. The recent ‘nods’ to Jean-Marie Lehn (Nobel, 2006) and Frazier Stoddard (Nobel, 2016)** codifies this focus in chemistry going forward. The overarching goal in the study of how molecules interact is to predict and design materials…

Read More