B.K. Sagar

Vibrational spectra, HOMO, LUMO, NBO, MEP analysis and molecular docking study of 2,2-diphenyl-4-(piperidin-1-yl)butanamide

Y. Sheena Mary, Hema Tresa Varghese, C. Yohannan Panicker et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2015 · 77 citations

Vibrational Spectra, Engineering, Biochemistry +10

Spectroscopic characterization of 4-[2-(5-Ethylpyridin-2-yl)ethoxy]benzaldehyde oxime and investigation of its reactive properties by DFT calculations and molecular dynamics simulations

K. Jalaja, Y. Sheena Mary, C. Yohannan Panicker et al. · Journal of Molecular Structure · 2016 · 29 citations

Molecular Spectroscopy, Engineering, Reactive Properties +9

Synthesis, characterization, crystal structure biological activity of 4-{2-[5-(4-fluoro-phenyl)- [1,3,4]oxadiazol-2-ylsulfanyl]-ethyl}-morpholine

Mamatha S.V, Mahesh Bhat, B.K. Sagar et al. · Journal of Molecular Structure · 2019 · 13 citations

Pharmacology, Organic Chemistry, Pharmaceutical Chemistry

Six 1-aroyl-4-(4-methoxyphenyl)piperazines: similar molecular structures but different patterns of supramolecular assembly

H. Kiran Kumar, H.S. Yathirajan, B.K. Sagar et al. · Acta Crystallographica Section E Crystallographic Communications · 2019 · 10 citations · Full text