Data for: "Data mining crystallization kinetics"

Dataset

Description

This is the dataset associated with the article titled "Data mining crystallisation kinetics".

Files within this dataset:
Molecular descriptors employed in random forests of the compounds in the database (moe_descriptors.csv)
All the data collected without pre-processing, observations whose kinetic parameters were a function of solvent or antisolvent concentration, observations whose growth was measured as volume, data adjusted according to what was explained in the article (dataset_raw.csv)
All the data collected with preprocessing, observations whose kinetic parameters were a function of solvent or antisolvent concentration, observations whose growth was measured as volume, data adjusted according to what was explained in the article (dataset_preprocessed.csv)
Code employed to perform cluster analysis and random forests in R (script.html)
Date made available30 Jan 2020
PublisherUniversity of Strathclyde
Date of data production1 May 2019 - 31 Aug 2019

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