Data mining crystallization kinetics
Diego A. Maldonado, Antony D. Vassileiou, Blair F. Johnston, Alastair J. Florence, Cameron J. Brown
Abstract
The database contains information on crystallization kinetics that describes crystal growth and primary nucleation for small molecules. In total, there are more than 336 datapoints distributed in more than 90 different chemical entities.
Topics & Concepts
CrystallizationNucleationKineticsCrystal growthCrystal (programming language)Materials scienceCrystallographyComputer scienceData miningChemistryPhysicsOrganic chemistryQuantum mechanicsProgramming languageCrystallization and Solubility StudiesComputational Drug Discovery MethodsAnalytical Chemistry and Chromatography