The reliability of organic molecular crystal structure prediction has improved tremendously in
recent years. Crystal structure predictions for small, mostly rigid molecules are quickly …

Achieving rapid global agricultural development while maintaining ecological harmony is a
major challenge of the new millennium. Meeting this challenge requires the development of …

The solid form screening of galunisertib produced many solvates, prompting an extensive
investigation into possible risks to the development of the favored monohydrate form …

Chemical compounds that exist in multiple crystalline forms are said to exhibit
polymorphism. Polymorphs have the same composition, but their structures and properties …

Crystal structure prediction based on searching for the global minimum in the lattice energy
(CSP_0) is growing in use for guiding the discovery of new materials, for example, new …

In the introduction to this review the complex chemistry of solid-state pharmaceutical
compounds is summarized. It is also explained why the density functional theory (DFT) …

Cocrystal engineering is gaining interest across various disciplines since it can effectively
tune the properties of solid substances via noncovalent synthesis by introducing new …

A strategy of using crystal structure prediction (CSP) methods to determine which, if any,
isostructural template could facilitate the first crystallization of a predicted polymorph by …

Over the past three decades, the development of methods for Crystal Structure Prediction
(CSP) has primarily been curiosity-driven. Because of the obvious potential for economic …

Heterogeneous crystal nucleation is ubiquitous in nature and at the heart of many industrial
applications. At the molecular scale, however, major gaps in understanding this …