Class information for:
Level 1: NUMERICALLY UNITARY STRUCTURE INDICES//UNITARY STRUCTURAL INDICES//MOLECULAR TRANSFORM

Basic class information
Class id #P Avg. number of
references		 Database coverage
of references
28075 214 20.7 26%


Bar chart of Publication_year

Last years might be incomplete

Hierarchy of classes
The table includes all classes above and classes immediately below the current class.


Cluster id Level Cluster label #P
5 4 CHEMISTRY, ORGANIC//CHEMISTRY, INORGANIC & NUCLEAR//CHEMISTRY, MULTIDISCIPLINARY 1745167
654 3       POLYOXYMETHYLENE DIMETHYL ETHERS//CROSS INTERACTION CONSTANT//PSEUDOACID 11347
3770 2             DISSOLVENCE//FLUORINATED UREAS//GRP PHARMACOCHEM 993
28075 1                   NUMERICALLY UNITARY STRUCTURE INDICES//UNITARY STRUCTURAL INDICES//MOLECULAR TRANSFORM 214

Terms with highest relevance score


rank Term termType Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class
1 NUMERICALLY UNITARY STRUCTURE INDICES authKW 285378 1% 100% 2
2 UNITARY STRUCTURAL INDICES authKW 285378 1% 100% 2
3 MOLECULAR TRANSFORM authKW 190250 1% 67% 2
4 COMPLEX WITH CALCIUM THIOCYANATE authKW 142689 0% 100% 1
5 ENTHALPY FREE ENERGY OF H COMPLEX FORMATION authKW 142689 0% 100% 1
6 EQUILIBRIUM CONSTANTS OF HYDROGEN BONDING authKW 142689 0% 100% 1
7 ESTROGEN RECEPTOR AFFINITIES authKW 142689 0% 100% 1
8 EXCESS DIELECTRIC PERMITTIVITIES AND MOLAR POLARIZATION authKW 142689 0% 100% 1
9 FREE ENERGIES OF SINGLE AND COOPERATIVE HYDROGEN BONDS authKW 142689 0% 100% 1
10 INTEGRATED MOLECULAR TRANSFORM INDEX authKW 142689 0% 100% 1

Web of Science journal categories


Rank Term Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class
1 Chemistry, Multidisciplinary 1455 53% 0% 113
2 Mathematics, Interdisciplinary Applications 268 8% 0% 18
3 Chemistry, Physical 160 21% 0% 44
4 Physics, Atomic, Molecular & Chemical 62 8% 0% 17
5 Pharmacology & Pharmacy 43 11% 0% 23
6 Chemistry, Medicinal 38 5% 0% 10
7 Multidisciplinary Sciences 33 2% 0% 5
8 Thermodynamics 32 4% 0% 8
9 Spectroscopy 27 4% 0% 8
10 Information Science & Library Science 23 2% 0% 4

Address terms


Rank Term Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class
1 PHYS THEORET CHEN 71343 0% 50% 1
2 CHEMOINFORMAT MOL MODELING 35671 0% 25% 1
3 KIRISHINEFTEORGSINTEZ PROD ASSOC 17834 0% 13% 1
4 CHEM DEV ENGN 11889 0% 8% 1
5 PHYS CHEM TECHNOL FOSSIL FUELS 7133 0% 5% 1
6 CHEMOINFORMAT 6791 1% 2% 2
7 UMR 7140 4073 1% 1% 2
8 KIEV POLYTECH 3782 1% 1% 3
9 GEOL GEOCHEM FOSSIL FUELS 3034 0% 2% 1
10 FAVORSKII CHEM 1087 0% 1% 1

Journals


Rank Term Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class
1 FINNISH CHEMICAL LETTERS 61641 5% 4% 11
2 ZHURNAL OBSHCHEI KHIMII 46209 24% 1% 51
3 KHIMIKO-FARMATSEVTICHESKII ZHURNAL 9423 6% 1% 13
4 ORGANIC REACTIVITY 4914 1% 1% 3
5 QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS 4614 2% 1% 4
6 NAUCHNO-TEKHNICHESKAYA INFORMATSIYA SERIYA 2-INFORMATSIONNYE PROTSESSY I SISTEMY 4469 2% 1% 4
7 INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 3274 7% 0% 16
8 UKRAINSKII KHIMICHESKII ZHURNAL 2950 4% 0% 8
9 MOLECULAR INFORMATICS 1158 1% 0% 2
10 BULLETIN DE L ACADEMIE POLONAISE DES SCIENCES-SERIE DES SCIENCES CHIMIQUES 969 0% 1% 1

Author Key Words


Rank Term Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class		 LCSH search Wikipedia search
1 NUMERICALLY UNITARY STRUCTURE INDICES 285378 1% 100% 2 Search NUMERICALLY+UNITARY+STRUCTURE+INDICES Search NUMERICALLY+UNITARY+STRUCTURE+INDICES
2 UNITARY STRUCTURAL INDICES 285378 1% 100% 2 Search UNITARY+STRUCTURAL+INDICES Search UNITARY+STRUCTURAL+INDICES
3 MOLECULAR TRANSFORM 190250 1% 67% 2 Search MOLECULAR+TRANSFORM Search MOLECULAR+TRANSFORM
4 COMPLEX WITH CALCIUM THIOCYANATE 142689 0% 100% 1 Search COMPLEX+WITH+CALCIUM+THIOCYANATE Search COMPLEX+WITH+CALCIUM+THIOCYANATE
5 ENTHALPY FREE ENERGY OF H COMPLEX FORMATION 142689 0% 100% 1 Search ENTHALPY+FREE+ENERGY+OF+H+COMPLEX+FORMATION Search ENTHALPY+FREE+ENERGY+OF+H+COMPLEX+FORMATION
6 EQUILIBRIUM CONSTANTS OF HYDROGEN BONDING 142689 0% 100% 1 Search EQUILIBRIUM+CONSTANTS+OF+HYDROGEN+BONDING Search EQUILIBRIUM+CONSTANTS+OF+HYDROGEN+BONDING
7 ESTROGEN RECEPTOR AFFINITIES 142689 0% 100% 1 Search ESTROGEN+RECEPTOR+AFFINITIES Search ESTROGEN+RECEPTOR+AFFINITIES
8 EXCESS DIELECTRIC PERMITTIVITIES AND MOLAR POLARIZATION 142689 0% 100% 1 Search EXCESS+DIELECTRIC+PERMITTIVITIES+AND+MOLAR+POLARIZATION Search EXCESS+DIELECTRIC+PERMITTIVITIES+AND+MOLAR+POLARIZATION
9 FREE ENERGIES OF SINGLE AND COOPERATIVE HYDROGEN BONDS 142689 0% 100% 1 Search FREE+ENERGIES+OF+SINGLE+AND+COOPERATIVE+HYDROGEN+BONDS Search FREE+ENERGIES+OF+SINGLE+AND+COOPERATIVE+HYDROGEN+BONDS
10 INTEGRATED MOLECULAR TRANSFORM INDEX 142689 0% 100% 1 Search INTEGRATED+MOLECULAR+TRANSFORM+INDEX Search INTEGRATED+MOLECULAR+TRANSFORM+INDEX

Core articles
The table includes core articles in the class. The following variables is taken into account for the relevance score of an article in a cluster c:
(1) Number of references referring to publications in the class.
(2) Share of total number of active references referring to publications in the class.
(3) Age of the article. New articles get higher score than old articles.
(4) Citation rate, normalized to year.


Rank Reference # ref.
in cl.		 Shr. of ref. in
cl.		 Citations
1 RAEVSKY, OA , GRIGOREV, VY , KIREEV, DB , ZEFIROV, NS , (1992) COMPLETE THERMODYNAMIC DESCRIPTION OF H-BONDING IN THE FRAMEWORK OF MULTIPLICATIVE APPROACH.QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS. VOL. 11. ISSUE 1. P. 49 -63 32 48% 74
2 MOLNAR, SP , KING, JW , (2001) THEORY AND APPLICATIONS OF THE INTEGRATED MOLECULAR TRANSFORM AND THE NORMALIZED MOLECULAR MOMENT STRUCTURE DESCRIPTORS: QSAR AND QSPR PARADIGMS.INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. VOL. 85. ISSUE 6. P. 662-675 6 100% 3
3 RAEVSKY, OA , GRIGORYEV, VY , SOLOVYEV, VP , (1989) MODELING OF STRUCTURE-ACTIVITY RELATIONSHIP .2. CALCULATION OF ELECTRONODONOR AND ACCEPTOR FUNCTIONS OF ACTIVE-CENTERS IN THE MOLECULES OF PHYSIOLOGICALLY ACTIVE COMPOUNDS.KHIMIKO-FARMATSEVTICHESKII ZHURNAL. VOL. 23. ISSUE 11. P. 1294-1300 13 59% 7
4 RAEVSKY, OA , (1999) DESCRIPTORS OF MOLECULAR STRUCTURE IN COMPUTER-AIDED DESIGN OF BIOLOGICALLY ACTIVE COMPOUNDS.USPEKHI KHIMII. VOL. 68. ISSUE 6. P. 555 -576 35 13% 18
5 KING, JW , MOLNAR, SP , (2005) STRUCTURAL CONNOTATIONS OF BIOACTIVITY IN A SERIES OF ORGANOPHOSPHINATES.INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. VOL. 105. ISSUE 6. P. 809-816 5 71% 0
6 RAEVSKY, OA , (1997) QUANTIFICATION OF NON-COVALENT INTERACTIONS ON THE BASIS OF THE THERMODYNAMIC HYDROGEN BOND PARAMETERS.JOURNAL OF PHYSICAL ORGANIC CHEMISTRY. VOL. 10. ISSUE 5. P. 405-413 10 43% 28
7 BOROVIKOV, YY , YURCHENKO, RI , KLEPA, TI , (1990) PROTON-ACCEPTOR ABILITY OF ADAMANTYL-1-PHOSPHITES.UKRAINSKII KHIMICHESKII ZHURNAL. VOL. 56. ISSUE 2. P. 172-177 6 100% 0
8 YURCHENKO, RI , KLEPA, TI , VOITSEKHOVSKAYA, OM , LAVROVA, EE , BASS, SI , (1990) PHOSPHORYLATED ADAMANTANES .10. H-ACCEPTOR PROPERTIES OF ADAMANTANE-CONTAINING PHOSPHORYL COMPOUNDS.ZHURNAL OBSHCHEI KHIMII. VOL. 60. ISSUE 10. P. 2280-2282 6 100% 0
9 YURCHENKO, RI , KLEPA, TI , LAVROVA, EE , TIKHONOV, VP , YURCHENKO, AG , (1989) PHOSPHORYLATED ADAMANTANES .9. INCREMENTS OF CHEMICAL-SHIFTS OF PROTONS OF A ADAMANTANE NUCLEUS IN PHOSPHORYLATED ADAMANTANE DERIVATIVES.ZHURNAL OBSHCHEI KHIMII. VOL. 59. ISSUE 9. P. 2004-2007 6 100% 1
10 RUOSTESUO, P , SALMINEN, U , LIIAS, R , (1987) THERMODYNAMIC AND SPECTROSCOPIC PROPERTIES OF PHOSPHORUS-COMPOUNDS - COMPLEX-FORMATION BETWEEN PHOSPHORUS-COMPOUNDS AND VARIOUS OH AND NH PROTON DONORS.SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY. VOL. 43. ISSUE 9. P. 1135-1139 6 100% 11

Classes with closest relation at Level 1


Rank Class id link
1 33802 GRP PHARMACOCHEM//FLAGGED OBSERVATIONS//GENERALIZED REGRESSION GENETIC NEURAL NETWORK
2 37218 CAMPHOR HYDRAZONE//CAMPHOR ALKYNES//CAMPHOR DERIVED LIGANDS
3 20949 ZHURNAL ORGANICHESKOI KHIMII//LM LYTVYNENKO PHYS ORGAN COAL CHEM//ORGANIC REACTIVITY
4 32220 CHEMICAL STRUCTURE MATRIX//OPTIMAL TOPOLOGICAL INDICES//THEORETICAL INFORMATION INDICES
5 26711 4 R DIBENZO 18 CROWN 6//SALSOLINE//4 4 5 DIBENZO 18 CROWN 6 DISULFONYL CHLORIDE
6 10176 SOLVATION PARAMETER MODEL//MOLECULAR SOLUTE DESCRIPTORS//LINEAR SOLVATION ENERGY RELATIONSHIPS
7 32883 ALKYL THIONOPHOSPHATE ESTERS//ARYL THIOPHOSPHORYL DERIVATIVES//ARYLPHOSPHOROTHIONATES
8 32054 1 4 DIAZABICYCLO 222OCTANE//1 DIMETHYLAMINO 2 PROPANONE//2 HYDROXY BENZHYDRAZIDE
9 25155 FLUORINATED UREAS//1 1 BISTRIFLUOROMETHYLALKYL ISOCYANATES//1 HYDROHEXAFLUOROISOBUTENYLOXYTFIMETHYLSILANE
10 36634 CHEM BIOCHEM ENGN THOMPSON ENGN BLDG//METHYLALUMINUM//ZHURNAL OBSHCHEI KHIMII

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