Biological Trace Element Research
Selected publications
A record of inquiry.
Selected work spanning structural bioinformatics, disease mechanisms and computational method development.
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ChemistrySelect
The Computational Study of Toxic Heavy Metal Binding to Cancer-Related Mutation Proteins
Cancer & metalloproteinsJournal of Proteome Research
The Study of Metalloproteome of DNA Viruses: Identification, Functional Annotation, and Diversity Analysis of Viral Metal-Binding Proteins
Viral biologyJournal of Virology
Metal-binding proteins and proteases in RNA viruses: unravelling functional diversity and expanding therapeutic horizons
Viral biologyJournal of Chemical Information and Modeling
Structural Distortion of β-Cyclodextrin Plays a Key Role in the pH-dependent Host–Guest Chemistry with Doxorubicin, Evident by the Electrochemical and Molecular Dynamics Approach
Molecular dynamicsBioinformation
YAPPIS-Finder: A novel method for protein-protein interaction site predictions
Method developmentBlood
Rational design of small molecules targeting the C2 domain of coagulation factor VIII
Structure-based drug designJournal of Molecular Graphics and Modelling
InCa-SiteFinder: A method for structure-based prediction of inositol and carbohydrate binding sites on proteins
Binding-site predictionJournal of Chemical Information and Modeling