Interaction energy profile for diphenyl diselenide in complex with δ-aminolevulinic acid dehydratase enzyme using quantum calculations and a molecular fragmentation method

Interaction energy profile for diphenyl diselenide in complex with δ-aminolevulinic acid dehydratase enzyme using quantum calculations and a molecular fragmentation method

Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Computational Toxicology - Volume 7, August 2018, Pages 9-19

Rogério A. Saraiva, Pablo A. Nogara, Roner F. Costa, Eveline M. Bezerra, Helenicy N.H. Veras, Irwin R.A. Menezes, Umberto L. Fulco, Eudenilson L. Albuquerque, Valder N. Freire, João B.T. Rocha,