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(A) Perspective of molecular docking of the Ni(II) complex with the major groove side of DNA by UCSF chimera, (B) two-dimensional interactions generated by LIGPLOT+.
Schematic representation of the calculated molecular-orbitals in CO22– (bent geometry) with their energy levels (eV).
(A) Molecular docking perspective of the Ru (II) complex with the major groove side of DNA using MVD. The complex depicted in a stick model, and DNA, represented in a wireframe model, (B) two-dimensional interactions generated by LIGPLOT.
(A) (A)tThe docked trans-[Cu(Pir)2(THF)2] complex in the binding pocket of BSA using MVD. The complex is depicted in a stick model, with BSA represented in a wireframe model; (B) two-dimensional interactions generated by LIGPLOT+.
(A) The docked trans-[Co(Mel)2(EtOH)2] complex in the binding pocket of BSA using MVD. The complex is depicted in a stick model, with BSA represented in a wireframe model; (B) two-dimensional interactions generated by LIGPLOT+.
(A) (A)tA molecular docking perspective of trans-[Cu(Pir)2(THF)2] with the major groove of DNA using UCSF Chimera. The complex is depicted in a stick model, and DNA is represented in a wireframe model; (B) two-dimensional interactions generated byLIGPLOT+
Molecular docking of the complex with DNA (A) and BSA (B)
(a) Molecular docking of the Rh(III) complex with DNA. (b) The bases of DNA with dominant interactions with the complex in the active site
Recent Crystal Structures
Useful Links
Dr. M. Daryanavard(2013-2014)
Relative Experiences
Rice waste /polymer composites
Single Chamber Microbial Fuel Cell
Modeling and Simulation of Microbial Fuel Cells