Vivekanand V. Gobre

Machine learning of molecular electronic properties in chemical compound space

Grégoire Montavon, Matthias Rupp, Vivekanand V. Gobre et al. · Repository for Publications and Research Data (ETH Zurich) · 2013 · 391 citations · Full text

Dispersion Interactions with Density-Functional Theory: Benchmarking Semiempirical and Interatomic Pairwise Corrected Density Functionals

Noa Marom, Alexandre Tkatchenko, Mariana Rossi et al. · Journal of Chemical Theory and Computation · 2011 · 306 citations

Benchmarking Semiempirical, Engineering, Physics +15

Scaling laws for van der Waals interactions in nanostructured materials

Vivekanand V. Gobre, Alexandre Tkatchenko · Nature Communications · 2013 · 290 citations · Full text

Synthesis, Electronic Structure, DNA and Protein Binding, DNA Cleavage, and Anticancer Activity of Fluorophore-Labeled Copper(II) Complexes

Satish S. Bhat, Anupa A. Kumbhar, H. Heptullah et al. · Inorganic Chemistry · 2010 · 262 citations

Density Functional Investigations on the Charge Distribution, Vibrational Spectra, and NMR Chemical Shifts in Cucurbit[<i>n</i>]uril (<i>n</i> = 5−12) Hosts

Vivekanand V. Gobre, Rahul V. Pinjari, Shridhar P. Gejji · The Journal of Physical Chemistry A · 2010 · 45 citations

Engineering, Physics, Physicochemical Analysis +14