Class information for:
Level 1: POTENTIAL ENERGY SURFACE AB INITIO CALCULATIONS//GEM DITHIOLS//KINETIC IR SPECTROSCOPY

Basic class information
ID Publications Average number
of references		 Avg. shr. active
ref. in WoS
25129 242 31.8 42%


Bar chart of Publication_year

Last years might be incomplete

Classes in level above (level 2)


ID, lev.
above		 Publications Label for level above
1711 6110 LINEAR DICHROIC EFFECTS//PROTON SPONGES//H D ISOTOPIC EFFECTS

Terms with highest relevance score


Rank Term Type of term Relevance score
(tfidf)		 Class's shr.
of term's tot.
occurrences		 Shr. of publ.
in class containing
term		 Num. of
publ.
in class
1 POTENTIAL ENERGY SURFACE AB INITIO CALCULATIONS Author keyword 1 100% 1% 2
2 GEM DITHIOLS Author keyword 1 50% 0% 1
3 KINETIC IR SPECTROSCOPY Author keyword 1 50% 0% 1
4 POLYCONJUGATED POLYMERS Author keyword 1 50% 0% 1
5 PROTON TRANSFER BARRIERS Author keyword 1 50% 0% 1
6 CHEM MOLEC DESIGN Address 0 33% 0% 1
7 PSEUDORECEPTOR MODELING Author keyword 0 25% 0% 1
8 UPR 5401 CNRS Address 0 17% 0% 1
9 COUPLING FUNCTIONS Author keyword 0 14% 0% 1
10 ETUDE THEOR MILIEUX EXTREMES Address 0 13% 0% 1

Web of Science journal categories

Author Key Words


Rank Web of Science journal category Relevance score
(tfidf)		 Class's shr.
of term's tot.
occurrences		 Shr. of publ.
in class containing
term		 Num. of
publ.
in class		 LCSH search Wikipedia search
1 POTENTIAL ENERGY SURFACE AB INITIO CALCULATIONS 1 100% 1% 2 Search POTENTIAL+ENERGY+SURFACE++AB+INITIO+CALCULATIONS Search POTENTIAL+ENERGY+SURFACE++AB+INITIO+CALCULATIONS
2 GEM DITHIOLS 1 50% 0% 1 Search GEM+DITHIOLS Search GEM+DITHIOLS
3 KINETIC IR SPECTROSCOPY 1 50% 0% 1 Search KINETIC+IR+SPECTROSCOPY Search KINETIC+IR+SPECTROSCOPY
4 POLYCONJUGATED POLYMERS 1 50% 0% 1 Search POLYCONJUGATED+POLYMERS Search POLYCONJUGATED+POLYMERS
5 PROTON TRANSFER BARRIERS 1 50% 0% 1 Search PROTON+TRANSFER+BARRIERS Search PROTON+TRANSFER+BARRIERS
6 PSEUDORECEPTOR MODELING 0 25% 0% 1 Search PSEUDORECEPTOR+MODELING Search PSEUDORECEPTOR+MODELING
7 COUPLING FUNCTIONS 0 14% 0% 1 Search COUPLING+FUNCTIONS Search COUPLING+FUNCTIONS
8 SULFUR CONTAINING POLYMERS 0 10% 0% 1 Search SULFUR+CONTAINING+POLYMERS Search SULFUR+CONTAINING+POLYMERS
9 1 HALOGENOPROPANE 2 THIONES 0 100% 0% 1 Search 1+HALOGENOPROPANE+2+THIONES Search 1+HALOGENOPROPANE+2+THIONES
10 ALCOHOL SELF ASSOCIATION 0 100% 0% 1 Search ALCOHOL+SELF+ASSOCIATION Search ALCOHOL+SELF+ASSOCIATION

Key Words Plus


Rank Web of Science journal category Relevance score
(tfidf)		 Class's shr.
of term's tot.
occurrences		 Shr. of publ.
in class containing
term		 Num. of
publ.
in class
1 BENT HYDROGEN BONDS 4 75% 1% 3
2 SCF CI CALCULATIONS 2 67% 1% 2
3 SINGLET GROUND STATES 2 67% 1% 2
4 OH2 2 36% 2% 4
5 CORRELATION ENERGY DEPENDENCE 1 50% 1% 2
6 CLASTIC BINDING 1 50% 0% 1
7 H3NHOH2 1 50% 0% 1
8 DISTORTION ENERGIES 1 15% 2% 4
9 CONSISTENT FIELD METHODS 1 19% 1% 3
10 BONDED ATOMS 1 22% 1% 2

Journals

Reviews


Title Publ. year Cit. Active references % act. ref.
to same field
Chemistry of halomethyl thioketones 2003 3 6 83%
BENT HYDROGEN-BONDS AND PROTON TRANSFERS 1994 106 36 39%
THEORETICAL-STUDIES OF PROTON TRANSFERS 1985 219 31 58%
Calculation of isotope effects from first principles 2000 39 52 12%
THEORETICAL CALCULATION OF ENERGETICS OF PROTON TRANSLOCATION THROUGH MEMBRANES 1986 7 15 67%
ELECTRON-TRANSFER AND CHARGE-TRANSFER CLASTIC BINDING HYPOTHESES FOR DRUG RECEPTOR INTERACTIONS 1987 3 4 75%
GRADIENT LINES ON THE MULTIDIMENSIONAL POTENTIAL-ENERGY SURFACES AND MECHANISMS OF CHEMICAL-REACTIONS 1994 32 129 2%

Address terms


Rank Address term Relevance score
(tfidf)		 Class's shr.
of term's tot.
occurrences		 Shr. of publ.
in class containing
term		 Num. of
publ.
in class
1 CHEM MOLEC DESIGN 0 33% 0.4% 1
2 UPR 5401 CNRS 0 17% 0.4% 1
3 ETUDE THEOR MILIEUX EXTREMES 0 13% 0.4% 1
4 ENGN MOLE ENGN 0 100% 0.4% 1

Related classes at same level (level 1)


Rank Relatedness score Related classes
1 0.0000257030 ZUNDEL CATION//PROTONATED WATER CLUSTERS//OSS2 POTENTIAL
2 0.0000245482 AB INITIO QUANTUM MECHANICAL//NITROSTYRENE DERIVATIVES//SEMIEMPIRICAL QUANTUM MECHANICAL
3 0.0000167521 SECOND ORDER MOLLER PLESSET PERTURBATION THEORY MP2//ATOMIC OXYGEN RADICAL ANION//EVEN ELECTRON IONS
4 0.0000148559 AQUEOUS PERCHLORIC ACID//NEAT LIQUIDS//STRUCTURAL DIFFUSION
5 0.0000145543 HYDROGEN BONDED CHAIN//HYDROGEN BONDED SYSTEM//ASYMMETRIC DOUBLE WELL POTENTIAL
6 0.0000136804 C 13 LABELED SYNTHONS//BIOENERGY ENVIRONM SCI GRP//DATA PROC PROD GRP
7 0.0000118023 C ACIDS//CARBON ACIDS//TRANSITION STATE IMBALANCE
8 0.0000107003 CHEMICAL HAMILTONIAN APPROACH//BASIS SET SUPERPOSITION ERROR//INTERMOLECULAR PERTURBATION THEORY
9 0.0000103395 PRODUCT AUTHENTICITY//HEMIACETAL REACTION//ALEKSANDER JABLONSKI PHYS
10 0.0000103097 SN2 REACTIONS//SN2 REACTION//MENSHUTKIN REACTION