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The experimental data for isotherm modelling were obtained by conducting the adsorption experiments using 1 g of TCPEI and 40 mL solutions of different Hg II) concentrations under continuous stirring.
The amino acid sequences and three dimensional structures of the homologous proteins used as templates for comparative modelling were obtained from the Protein Data Bank (http://www.rcsb.org/pdb).
Sequences used for bioinformatics sequence analysis and homology modelling were obtained from the NCBI RefSeq database.
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Significant models were obtained.
Seven LDA-based QSAR models were obtained.
Two QSAR regression models were obtained from INCHEMICOTOX.
Training datasets for both models were obtained from JRC QSAR Models Database.
At these optimal conditions, kinetics and isotherm models were obtained.
Two linear discriminant analysis (LDA) models were obtained.
The corresponding parameters for the three models were obtained.
Specific solutions of the general model were obtained.
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