Class information for: |
Basic class information |
Class id | #P | Avg. number of references |
Database coverage of references |
---|---|---|---|
384 | 17031 | 44.4 | 61% |
Hierarchy of classes |
The table includes all classes above and classes immediately below the current class. |
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 | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | WoSSC | 182446 | 41% | 2% | 6962 |
2 | JOURNAL OF COMPUTATIONAL CHEMISTRY | journal | 182386 | 5% | 13% | 791 |
3 | CHEMISTRY, PHYSICAL | WoSSC | 144635 | 60% | 1% | 10268 |
4 | JOURNAL OF CHEMICAL THEORY AND COMPUTATION | journal | 140733 | 4% | 13% | 602 |
5 | INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | journal | 110414 | 5% | 8% | 831 |
6 | JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | journal | 102216 | 5% | 7% | 809 |
7 | JOURNAL OF PHYSICAL CHEMISTRY A | journal | 96479 | 7% | 4% | 1276 |
8 | FUKUI FUNCTION | authKW | 72118 | 1% | 41% | 99 |
9 | THEORETICAL CHEMISTRY ACCOUNTS | journal | 69184 | 2% | 12% | 328 |
10 | JOURNAL OF CHEMICAL PHYSICS | journal | 67138 | 11% | 2% | 1820 |
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 | Physics, Atomic, Molecular & Chemical | 182446 | 41% | 2% | 6962 |
2 | Chemistry, Physical | 144635 | 60% | 1% | 10268 |
3 | Chemistry, Multidisciplinary | 19864 | 24% | 0% | 4081 |
4 | Mathematics, Interdisciplinary Applications | 8431 | 5% | 1% | 933 |
5 | Crystallography | 3488 | 4% | 0% | 765 |
6 | Computer Science, Interdisciplinary Applications | 705 | 2% | 0% | 409 |
7 | Chemistry, Inorganic & Nuclear | 587 | 3% | 0% | 546 |
8 | Chemistry, Organic | 313 | 4% | 0% | 634 |
9 | Biophysics | 37 | 2% | 0% | 297 |
10 | Mathematical & Computational Biology | 31 | 1% | 0% | 98 |
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 | CHIM THEOR | 55107 | 1% | 15% | 210 |
2 | UMR 7616 | 49312 | 1% | 25% | 110 |
3 | EENHEID ALGEMENE CHEM | 46191 | 0% | 53% | 49 |
4 | K GUMINSKI THEORET CHEM | 38123 | 0% | 42% | 51 |
5 | CHEM | 36014 | 31% | 0% | 5261 |
6 | WETEN PEN | 34513 | 0% | 30% | 64 |
7 | QUIM TEOR COMPUTAC QTC | 32712 | 0% | 52% | 35 |
8 | MOL THEORY GRP | 27223 | 0% | 72% | 21 |
9 | SUPERCOMP | 25621 | 1% | 10% | 144 |
10 | THEORET CHEM | 23038 | 2% | 4% | 355 |
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 | JOURNAL OF COMPUTATIONAL CHEMISTRY | 182386 | 5% | 13% | 791 |
2 | JOURNAL OF CHEMICAL THEORY AND COMPUTATION | 140733 | 4% | 13% | 602 |
3 | INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | 110414 | 5% | 8% | 831 |
4 | JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 102216 | 5% | 7% | 809 |
5 | JOURNAL OF PHYSICAL CHEMISTRY A | 96479 | 7% | 4% | 1276 |
6 | THEORETICAL CHEMISTRY ACCOUNTS | 69184 | 2% | 12% | 328 |
7 | JOURNAL OF CHEMICAL PHYSICS | 67138 | 11% | 2% | 1820 |
8 | CHEMICAL PHYSICS LETTERS | 36154 | 6% | 2% | 990 |
9 | THEORETICA CHIMICA ACTA | 34516 | 1% | 12% | 164 |
10 | COMPUTATIONAL AND THEORETICAL CHEMISTRY | 13707 | 1% | 6% | 134 |
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 | FUKUI FUNCTION | 72118 | 1% | 41% | 99 | Search FUKUI+FUNCTION | Search FUKUI+FUNCTION |
2 | ATOMS IN MOLECULES | 65941 | 1% | 42% | 88 | Search ATOMS+IN+MOLECULES | Search ATOMS+IN+MOLECULES |
3 | POLARIZABLE FORCE FIELD | 54100 | 0% | 67% | 45 | Search POLARIZABLE+FORCE+FIELD | Search POLARIZABLE+FORCE+FIELD |
4 | CONCEPTUAL DFT | 53905 | 0% | 60% | 50 | Search CONCEPTUAL+DFT | Search CONCEPTUAL+DFT |
5 | ELECTRON LOCALIZATION FUNCTION | 48507 | 0% | 42% | 64 | Search ELECTRON+LOCALIZATION+FUNCTION | Search ELECTRON+LOCALIZATION+FUNCTION |
6 | WATER CLUSTERS | 43206 | 1% | 23% | 106 | Search WATER+CLUSTERS | Search WATER+CLUSTERS |
7 | VALENCE BOND | 40991 | 0% | 55% | 42 | Search VALENCE+BOND | Search VALENCE+BOND |
8 | QUANTUM CHEMICAL TOPOLOGY | 36719 | 0% | 71% | 29 | Search QUANTUM+CHEMICAL+TOPOLOGY | Search QUANTUM+CHEMICAL+TOPOLOGY |
9 | ELECTROPHILICITY | 36194 | 0% | 31% | 66 | Search ELECTROPHILICITY | Search ELECTROPHILICITY |
10 | CONCEPTUAL DENSITY FUNCTIONAL THEORY | 35596 | 0% | 76% | 26 | Search CONCEPTUAL+DENSITY+FUNCTIONAL+THEORY | Search CONCEPTUAL+DENSITY+FUNCTIONAL+THEORY |
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 | GEERLINGS, P , DE PROFT, F , LANGENAEKER, W , (2003) CONCEPTUAL DENSITY FUNCTIONAL THEORY.CHEMICAL REVIEWS. VOL. 103. ISSUE 5. P. 1793 -1873 | 407 | 73% | 1801 |
2 | GORDON, MS , FEDOROV, DG , PRUITT, SR , SLIPCHENKO, LV , (2012) FRAGMENTATION METHODS: A ROUTE TO ACCURATE CALCULATIONS ON LARGE SYSTEMS.CHEMICAL REVIEWS. VOL. 112. ISSUE 1. P. 632 -672 | 351 | 70% | 252 |
3 | TOMASI, J , MENNUCCI, B , CAMMI, R , (2005) QUANTUM MECHANICAL CONTINUUM SOLVATION MODELS.CHEMICAL REVIEWS. VOL. 105. ISSUE 8. P. 2999 -3093 | 245 | 35% | 5941 |
4 | CISNEROS, GA , WIKFELDT, KT , OJAMAE, L , LU, JB , XU, Y , TORABIFARD, H , BARTOK, AP , CSANYI, G , MOLINERO, V , PAESANI, F , (2016) MODELING MOLECULAR INTERACTIONS IN WATER: FROM PAIRWISE TO MANY BODY POTENTIAL ENERGY FUNCTIONS.CHEMICAL REVIEWS. VOL. 116. ISSUE 13. P. 7501 -7528 | 175 | 63% | 11 |
5 | MARENICH, AV , CRAMER, CJ , TRUHLAR, DG , (2009) UNIVERSAL SOLVATION MODEL BASED ON SOLUTE ELECTRON DENSITY AND ON A CONTINUUM MODEL OF THE SOLVENT DEFINED BY THE BULK DIELECTRIC CONSTANT AND ATOMIC SURFACE TENSIONS.JOURNAL OF PHYSICAL CHEMISTRY B. VOL. 113. ISSUE 18. P. 6378-6396 | 74 | 77% | 2377 |
6 | SENN, HM , THIEL, W , (2009) QM/MM METHODS FOR BIOMOLECULAR SYSTEMS.ANGEWANDTE CHEMIE-INTERNATIONAL EDITION. VOL. 48. ISSUE 7. P. 1198 -1229 | 219 | 40% | 808 |
7 | CHATTARAJ, PK , GIRI, S , DULEY, S , (2011) UPDATE 2 OF: ELECTROPHILICITY INDEX.CHEMICAL REVIEWS. VOL. 111. ISSUE 2. P. PR43 -PR75 | 285 | 53% | 71 |
8 | FEDOROV, DG , NAGATA, T , KITAURA, K , (2012) EXPLORING CHEMISTRY WITH THE FRAGMENT MOLECULAR ORBITAL METHOD.PHYSICAL CHEMISTRY CHEMICAL PHYSICS. VOL. 14. ISSUE 21. P. 7562 -7577 | 178 | 75% | 76 |
9 | PERSICO, M , TOMASI, J , (1994) MOLECULAR-INTERACTIONS IN SOLUTION - AN OVERVIEW OF METHODS BASED ON CONTINUOUS DISTRIBUTIONS OF THE SOLVENT.CHEMICAL REVIEWS. VOL. 94. ISSUE 7. P. 2027 -2094 | 175 | 43% | 3802 |
10 | CHATTARAJ, PK , SARKAR, U , ROY, DR , (2006) ELECTROPHILICITY INDEX.CHEMICAL REVIEWS. VOL. 106. ISSUE 6. P. 2065 -2091 | 189 | 52% | 578 |
Classes with closest relation at Level 2 |