3.6(top 10%)
impact factor
38.7K(top 1%)
papers
486.1K(top 1%)
citations
143(top 5%)
h-index
3.6(top 10%)
extended IF
41.3K
all documents
505.6K
doc citations
220(top 5%)
g-index

Top Articles

#TitleJournalYearCitations
1The Cologne Database for Molecular Spectroscopy, CDMS: a useful tool for astronomers and spectroscopistsJournal of Molecular Structure20051,496
2Inorganic electronic spectroscopyJournal of Molecular Structure1972979
3Physics of shock waves and high-temperature hydrodynamic phenomenaJournal of Molecular Structure1970832
4Interaction of drugs with bovine and human serum albuminJournal of Molecular Structure2002789
5Synthesis and characterization by FTIR spectroscopy of silica aerogels prepared using several Si(OR)4 and R′′Si(OR′)3 precursorsJournal of Molecular Structure2009733
6Materials selection guidelines for membranes that remove CO2 from gas mixturesJournal of Molecular Structure2005697
7Molvib - A flexible program for force field calculationsJournal of Molecular Structure1990657
8Towards an unified hydrogen-bond theoryJournal of Molecular Structure2000626
9Non-ideal effects in organic–inorganic materials for gas separation membranesJournal of Molecular Structure2005556
10Fluorescence quenching and ligand binding: A critical discussion of a popular methodologyJournal of Molecular Structure2011513
11Geometry optimization by direct inversion in the iterative subspaceJournal of Molecular Structure1984505
12MicroScale Thermophoresis: Interaction analysis and beyondJournal of Molecular Structure2014503
13The chemist's companionJournal of Molecular Structure1973476
14Structure and barrier of internal rotation of biphenyl derivatives in the gaseous stateJournal of Molecular Structure1985475
15The hydrogen bond network in I β cellulose as observed by infrared spectrometryJournal of Molecular Structure2000475
16Solvent effects on the photochemical and fluorescence properties of zinc phthalocyanine derivativesJournal of Molecular Structure2003447
17Spectroscopic studies on the interaction of cinnamic acid and its hydroxyl derivatives with human serum albuminJournal of Molecular Structure2004446
18Studies of interaction between colchicine and bovine serum albumin by fluorescence quenching methodJournal of Molecular Structure2005441
19Crystal and molecular structure of 4-carboxypiperidinium chloride (4-piperidinecarboxylic acid hydrochloride)Journal of Molecular Structure2007419
20The structure and properties of waterJournal of Molecular Structure1970404
21Average structures of butadiene, acrolein, and glyoxal determined by gas electron diffraction and spectroscopyJournal of Molecular Structure1968403
22The dielectric response of simple organic glass formersJournal of Molecular Structure1999399
23Supramolecular ChemistryJournal of Molecular Structure1992393
24Investigation of the interaction between flavonoids and human serum albuminJournal of Molecular Structure2004390
25Structural and electronic contributions to hyperpolarizability in methyl p-hydroxy benzoateJournal of Molecular Structure2006388
26The microwave spectrum, structure and dipole moment of anilineJournal of Molecular Structure1974386
27FTIR and XRD evaluation of carbonated hydroxyapatite powders synthesized by wet methodsJournal of Molecular Structure2005365
28Periodic potential functions for pseudorotation and internal rotationJournal of Molecular Structure1972363
29Stability and structural features of DNA intercalation with ethidium bromide, acridine orange and methylene blueJournal of Molecular Structure2007362
30Molecular structure of benzeneJournal of Molecular Structure1976356
31Stretching frequency versus bond distance correlation of OD(H)⋯Y (Y  N, O, S, Se, Cl, Br, I) hydrogen bonds in solid hydratesJournal of Molecular Structure1986342
32Frontier Orbitals and Organic Chemical ReactionsJournal of Molecular Structure1979331
33The effects of magnetic fields on water molecular hydrogen bondsJournal of Molecular Structure2009321
34Infrared spectra of surface hydroxyl groups and crystalline structure of oxidesJournal of Molecular Structure1973311
35Temperature dependence of the optical constants for liquid H2O and D2O in the far IR regionJournal of Molecular Structure1995309
36Structural, magnetic, dielectric and optical properties of nickel ferrite nanoparticles synthesized by co-precipitation methodJournal of Molecular Structure2014304
37Phase transitions in the system poly(N-isopropylacrylamide)/water and swelling behaviour of the corresponding networksJournal of Molecular Structure2000300
38Basic inorganic chemistryJournal of Molecular Structure1978291
39Study of the interaction between icariin and human serum albumin by fluorescence spectroscopyJournal of Molecular Structure2008286
40The synaptic order: a key concept to understand multicenter bondingJournal of Molecular Structure2002283
41An over review on recently developed techniques, mechanisms and intermediate involved in the advanced azo dye degradation for industrial applicationsJournal of Molecular Structure2021283
42IR-analysis of H-bonded H2O on the pure TiO2 surfaceJournal of Molecular Structure2004282
43Microwave spectra of isotopic pyrroles. Molecular structure, dipole moment, and 14N quadrupole coupling constants of pyrroleJournal of Molecular Structure1969276
44Evaluation of morphological and chemical aspects of different wood species by spectroscopy and thermal methodsJournal of Molecular Structure2011269
45Raman, mid-infrared, near-infrared and ultraviolet–visible spectroscopy of PDMS silicone rubber for characterization of polymer optical waveguide materialsJournal of Molecular Structure2010266
46An alternative calculation of the vibrational potential energy distributionJournal of Molecular Structure1971258
47Green synthesis and characterization of zinc oxide nanoparticles with antibacterial and antifungal activityJournal of Molecular Structure2020258
48Influence of magnetic field on physical–chemical properties of the liquid water: Insights from experimental and theoretical modelsJournal of Molecular Structure2008254
49On the determination of uraniumoxygen bond lengths in dioxouranium(VI) compounds by Raman spectroscopyJournal of Molecular Structure1989250
50Fast determination of the quantitative secondary structure of proteins by using some parameters of the Raman Amide I bandJournal of Molecular Structure1988247