OOIR: Observatory of International Research

Papers

(The H4-Index of Structural Chemistry is 21. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2021-05-01 to 2025-05-01.)

Article	Citations
Fragment-based inhibitor design for SARS-CoV2 main protease	40
Synthesis, spectral characteristics and molecular structure of N-(1-(5-amino-1H-1,2,4-triazol-1-yl)-2,2,2-trichloroethyl)carboxamides	39
Synthesis, characterizations, and computational studies of new tetrasubstituted imidazole containing a benzothiazole moiety	38
Salts containing different amino acids: l-argininium ( +) sarcosine halogenides	35
Impact of hetero-atom doping on electronic structure and reactivity of anionic Al13− cluster: a combined density functional theory and global optimization investigation	33
Structure, vibrational characterization and DFT calculations of 1-(diaminomethylene)thiouron-1-ium 2,3-pyridinedicarboxylate	33
Elucidation of the enantiomer migration order of atenolol by theoretical calculations	30
On substituent effect in 1,n–homodisubstituted polyenes	29
Crystal structure and Hirshfeld surface analysis of copper(II) β-aminovinyl ketone complexes	29
Discovery of slow neutrons 90 years ago – A tribute to Enrico Fermi	29
Adsorption behavior of anti-cancer procarbazine on the surface of on pristine, Al-, Si-, and C-doped B24N24 fullerenes based on the density functional theory	28
Adsorption attributes of methyl naphthalene and naphthalene on P-Germanane sheets–a DFT outlook	28
Mikhail S. Tsvet—pioneer of chromatography—150 years from his birth	26
Different topology of mixed valence CoIICoIII complexes with SCN anions and hydrazone–pyridine-based ligands	25
Quantum chemical investigation on D-π-A-based phenothiazine organic chromophores with spacer and electron acceptor effects for DSSCs	25
DFT and NBO computational calculations support Schleyer’s hyperconjugative enhancement of aromaticity concept	23
The conceptual power of the Hellmann–Feynman theorem	23
Structural evolution and electronic properties of medium-sized CrSin−/0 (n = 19–25) clusters	22
Exploring structural requirements of simple benzene derivatives for adsorption on carbon nanotubes: CoMFA, GRIND, and HQSAR	22
Effect of hydrophobic groups on adsorption of arginine-based amino acids to solid surfaces in water	21
Tautomeric behavior of 1,2,4-triazole derivatives: combined spectroscopic and theoretical study	21
Energy contribution of heterocyclic sulfur and a disulfide bond in solid and gaseous phase	21
Design of hACE2-based small peptide inhibitors against spike protein of SARS-CoV-2: a computational approach	21