Virtual melting can occur in a range of materials from ice to metals. (Courtesy: iStock/ninikas) Shear-induced structural transitions happen when the structure of a material changes due to the ...

We present a high-throughput, end-to-end pipeline for organic crystal structure prediction (CSP)─the problem of identifying the stable crystal structures that will form from a given molecule based ...

We have determined the crystal structure of a homo-DNA octamer. It reveals a weakly twisted right-handed duplex with a strong inclination between the hexose−phosphate backbones and base-pair axes, and ...