A crucial theme in molecular biology is the unrelenting connection between structure and function. Life is a complex bit of chemistry, and so by understanding the structures of molecules we can use ...

The drug development pipeline is a costly and lengthy process. Identifying high-quality "hit" compounds-those with high potency, selectivity, and favorable metabolic properties-at the earliest stages ...

Using advanced computer modeling, researchers at the U.S. Department of Energy's Argonne National Laboratory have developed a way to accurately predict the behavior of devices called molecular qubits.

LEMONT, Ill., August 26, 2025--(BUSINESS WIRE)--Using advanced computer modeling, researchers at the U.S. Department of Energy's Argonne National Laboratory have developed a way to accurately predict ...

In human cells, there are about 20,000 genes on a two-meter DNA strand—finely coiled up in a nucleus about 10 micrometers in diameter. By comparison, this corresponds to a 40-kilometer thread packed ...

A milestone report proposes a new technique for modeling molecular life with computers. The advance promises new insights into the fundamental biology of a cell, as well as faster and more precise ...

Computational modeling and simulation of nanomaterials strongly complement physical experiments. They enable the prediction of characteristics and processes under conditions difficult to replicate or ...

Scientists have developed a computer-aided data tool that could improve treatment for a range of illnesses. Scientists from Queen's University Belfast have developed a computer-aided data tool that ...

In this article, we will cover the best free Molecular Modeling software for Windows 11/10 PC. Using these freeware, you can create models of various simple to complex chemical compounds. This ...