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

Cocrystallizing a given molecule with another can be useful for adjusting the physical
properties of molecules in the solid state. However, most combinations of molecules do not …

Definitive characterization of pharmaceutical salt and cocrystal solid forms is crucial from
regulatory and intellectual property perspectives. Consequently, predicting acid–base solid …

The pharmaceutical industry is increasingly exploring cocrystals as a solution to provide
improved material properties for otherwise intractable active pharmaceutical ingredients …

Quadrupolar NMR crystallography guided crystal structure prediction (QNMRX-CSP) is a
nascent protocol for predicting, solving, and refining crystal structures. QNMRX-CSP …

The low solubility profile of drugs is one of the most demanding characteristics in drug
dosage development, restraining the bioavailability of any drug. Based on solubility and …