To combat climate change, the world needs green molecules in addition to green electrons. “If we look how the economy is ...

To continue reading this content, please enable JavaScript in your browser settings and refresh this page. Preview this article 1 min Fresh off a renewed investment ...

Department of Pharmacy and Biotechnology (FaBiT), Alma Mater Studiorum - University of Bologna, via Belmeloro 6, 40126 Bologna, Italy Computational & Chemical Biology, Fondazione Istituto Italiano di ...

Everything we can see and touch, and quite a lot that we can’t as well, is made of tiny particles called atoms. Some substances, like particles of this iron, contain only one kind of atom. Iron is an ...

Laboratory for Biomolecular Simulation Research, and Department of Chemistry and Chemical Biology, Rutgers the State University of New Jersey, New Brunswick, New Jersey 08901-8554, United States ...

In silico assessment of protein receptor interactions with small ligands is now part of the standard pipeline for drug discovery, and numerous tools and protocols have been developed for this purpose.

In this article, I demonstrate how you can setup and maintain a python friendly development environment from within Atom. Ideally, a developer wants to reduce the amount of window/application ...

The generated database GDB17 enumerates 166.4 billion molecules up to 17 atoms of C, N, O, S and halogens following simple rules of chemical stability and synthetic feasibility. However, most ...