Current research projects in the Alexov’s lab:

· Developing methods for pKa calculations accounting for conformational dynamics and H-bond geometry (details...)

· Developing docking algorithms allowing for conformation and ionization changes (details...)

· Testing limits of existing docking methods (details…)

· Missense mutations associated with X-Linked mental retardation: Computational modeling (details...)

· The effect of single nucleotide polymorphisms on protein structure, function and interactions: Application to spearmine synthase gene (details...)

· Developing an Algorithm to Calculate the Protein-Protein Free Energy Taking into Account Conformation and Ionization Changes (details...)

For contact information, please, see Alexov webpage  at Clemson University

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