OOIR: Observatory of International Research

Papers

(The H4-Index of Structural Chemistry is 20. 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 2022-06-01 to 2026-06-01.)

Article	Citations
Elucidation of the enantiomer migration order of atenolol by theoretical calculations	54
Discovery of slow neutrons 90 years ago – A tribute to Enrico Fermi	43
Fragment-based inhibitor design for SARS-CoV2 main protease	40
Impact of hetero-atom doping on electronic structure and reactivity of anionic Al13− cluster: a combined density functional theory and global optimization investigation	40
Structural diversity and the role of solvents in supramolecular arrangement of FeIIIPc(CN)(H2O) solvate crystals	39
Crystal structure and Hirshfeld surface analysis of copper(II) β-aminovinyl ketone complexes	38
Investigation of the impact of DMSO and H2O solvents on the electronic and photovoltaic properties of graphene-oxide nanostructures: A DFT study	36
Size evolution and property study on PdAgn (n = 1–17) clusters from density functional theory	35
Synthesis, Spectral Properties, Crystal Structure and DFT Studies of 2-((1-Phenyl-1H-1,2,3-triazol-4-yl)methoxy)benzonitrile	35
Trimethoxyphenyl-1,2,4-triazol-3-ones: synthesis, characterization, DFT, antimicrobial and acetylcholinesterase inhibitory activities with molecular docking and dynamics studies	30
Salts containing different amino acids: l-argininium ( +) sarcosine halogenides	28
Thiadiazole-furazan compounds: decomposition mechanism study by RMD and DFT	27
A DFT-based study to understand the adsorption of alanine on carbon nanocups	26
On substituent effect in 1,n–homodisubstituted polyenes	25
Avogadro constant and molecular crystals	23
Synthesis, characterizations, and computational studies of new tetrasubstituted imidazole containing a benzothiazole moiety	23
Synthesis, spectral characteristics and molecular structure of N-(1-(5-amino-1H-1,2,4-triazol-1-yl)-2,2,2-trichloroethyl)carboxamides	21
New bis-azido iron(III) meso-arylporphyrin complex: spectroscopic characterization, solid state molecular structure, DFT, MEP, QTAIM calculations and Hirshfeld surface analyses	21
Polymorphism and weak noncovalent interactions with unique halogen bonding in the supramolecular assemblies of (Z)-3-[(4-bromophenyl)amino]-2-cyanoprop-2-enoate	20
A new series of pyrazoles-based compounds: synthesis, HOMO–LUMO analysis, MEP, quantum reactivity, and in silico covid-19 activity	20
Structure, vibrational characterization and DFT calculations of 1-(diaminomethylene)thiouron-1-ium 2,3-pyridinedicarboxylate	20