OOIR: Observatory of International Research

Papers

(The H4-Index of International Journal of Quantum Chemistry is 24. 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 2020-11-01 to 2024-11-01.)

Article	Citations
Topological indices and QSPR/QSAR analysis of some antiviral drugs being investigated for the treatment of COVID‐19 patients	91
Distance based and bond additive topological indices of certain repurposed antiviral drug compounds tested for treating COVID‐19	53
Molecular trees with extremal values of Sombor indices	53
Topological indices and QSPR modeling of some novel drugs used in the cancer treatment	52
A comprehensive computational investigations on the physical properties of TiXSb (X: Ru, Pt) half‐Heusler alloys and Ti₂RuPtSb₂ double half‐	47
First‐principles calculations to investigate structural stabilities, mechanical and optoelectronic properties of NbCoSn and NbFeSb half‐Heusler compounds	41
Prediction the structure, mechanical properties and melting point ofD8_m‐Mo₅SiB₂andCmcm‐Mo₅SiB₂	40
A comparative review of 50 analytical representation of potential energy interaction for diatomic systems: 100 years of history	40
The strength of a chemical bond	39
Electronic and thermo‐physical properties of double antiperovskites X₆SOA₂ (X = Na, K and A = Cl, Br, I): A non‐toxic and efficient energy storage materials	37
Global optimization of chemical cluster structures: Methods, applications, and challenges	37
Molecular representations for machine learning applications in chemistry	35
More on Sombor indices of chemical graphs and their applications to the boiling point of benzenoid hydrocarbons	30
Quantum computational quantification of protein–ligand interactions	30
Linear versus cubic regression models for analyzing generalized reverse degree based topological indices of certain latest corona treatment drug molecules	29
The expected values for the Gutman index, Schultz index, and some Sombor indices of a random cyclooctane chain	28
Structural defects in graphene quantum dots: A review	28
Prediction of a new quaternary Heusler alloy within a good electrical response at high temperature for spintronics applications: DFT calculations	27
Induced magnetic states upon electron–hole injection at B and N sites of hexagonal boron nitride bilayer: A density functional theory study	27
Generalized unitary coupled cluster excitations for multireference molecular states optimized by the variational quantum eigensolver	26
The role of quantum chemistry in covalent inhibitor design	26
Li‐decorated Al₂C monolayer as a potential template for hydrogen storage: A first‐principles perspective	26
Simulating X‐ray absorption spectra with complete active space self‐consistent field linear response methods	25
New insight into the structural, mechanical, electronic, and thermodynamic properties of the monoclinicTMAl₃‐type aluminides	25