################################# #### PARCRYS DATASETS README #### ################################# The datasets in this directory were used for the development of the ParCrys Crystallisation Propensity Predictor method. For further details See: Overton, Padovani, Girolami & Barton (2008). "ParCrys: a Parzen window density estimation approach to protein crystallization propensity prediction". Bioinformatics 24:901-907 Training data: PDB3958 Feature selection data: DIF728, WS728 Independent test data: TPOS72, TNEG72, TPOS43, TNEG43 Additional independent test data: TPOS12, TNEG12 Also, datasets were developed from the feature selection data to further investigate the effects of length restriction on predictive performance. These are DIF246, WS246. Other datasets associated with method development: WS6025, TNEG610 Ian Overton & Geoffrey Barton (May 2007) Updated by Ian Overton (Aug 2008)