Class information for:
Level 1: PRINCIPAL PROPERTIES//QSAM//QUANTITATIVE SEQUENCE ACTIVITY MODEL

Basic class information

Class id #P Avg. number of
references
Database coverage
of references
19401 507 29.3 54%



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
430 3       JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES//JOURNAL OF CHEMICAL INFORMATION AND MODELING//QSAR 27693
1068 2             WIENER INDEX//QSAR//MATCH-COMMUNICATIONS IN MATHEMATICAL AND IN COMPUTER CHEMISTRY 9972
19401 1                   PRINCIPAL PROPERTIES//QSAM//QUANTITATIVE SEQUENCE ACTIVITY MODEL 507

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 PRINCIPAL PROPERTIES authKW 963623 3% 100% 16
2 QSAM authKW 361359 1% 100% 6
3 QUANTITATIVE SEQUENCE ACTIVITY MODEL authKW 361359 1% 100% 6
4 PROTEOCHEMOMETRICS authKW 333549 2% 46% 12
5 MULTIVARIATE DESIGN authKW 303630 2% 46% 11
6 MULTIVARIATE CHARACTERIZATION authKW 226726 2% 47% 8
7 AUGMENTED SIMPLEX DESIGN authKW 180679 1% 100% 3
8 HETEROCYCLIC AROMATICITY authKW 180679 1% 100% 3
9 PROBIT DOSE RESPONSE authKW 180679 1% 100% 3
10 QUANTITATIVE SEQUENCE ACTIVITY MODELING QSAM authKW 180679 1% 100% 3

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, Medicinal 1854 18% 0% 93
2 Automation & Control Systems 1807 13% 0% 64
3 Mathematics, Interdisciplinary Applications 1537 13% 0% 65
4 Statistics & Probability 1320 13% 0% 65
5 Computer Science, Artificial Intelligence 1213 13% 0% 67
6 Chemistry, Analytical 829 18% 0% 93
7 Instruments & Instrumentation 765 13% 0% 65
8 Chemistry, Multidisciplinary 597 24% 0% 122
9 Computer Science, Interdisciplinary Applications 484 9% 0% 45
10 Pharmacology & Pharmacy 242 15% 0% 76

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 STATE CHEMOBIOSENSORS CHEMOBIOMETR MOST 120453 0% 100% 2
2 STRUCT PROPERTY OPTIMIZAT 120453 0% 100% 2
3 TECHNOL LIFE SCI BIOTECHNOL 120453 0% 100% 2
4 UMR 3825 120449 1% 50% 4
5 BIOINFORMAT SIMULATC MOL 60226 0% 100% 1
6 BIOMED ENGN CHONGQING 60226 0% 100% 1
7 CHEMOBIOMED SCI ENGN CHONGQING MUNICIPA 60226 0% 100% 1
8 CHIM MOL FORMULAT EA 4479 60226 0% 100% 1
9 CHIM ORGAN PHYS CNRS URA 463 60226 0% 100% 1
10 DESS OPEX 60226 0% 100% 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 QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS 124782 6% 6% 32
2 JOURNAL OF CHEMOMETRICS 34562 6% 2% 28
3 CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS 24567 7% 1% 36
4 ACTA CHEMICA SCANDINAVICA SERIES B-ORGANIC CHEMISTRY AND BIOCHEMISTRY 16280 4% 2% 18
5 ACTA CHEMICA SCANDINAVICA 6763 3% 1% 15
6 ANALES DE QUIMICA SERIE C-QUIMICA ORGANICA Y BIOQUIMICA 3386 1% 1% 6
7 JOURNAL OF CHEMINFORMATICS 2684 1% 1% 4
8 JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN 1657 1% 0% 7
9 KEMISK TIDSKRIFT 1467 0% 2% 1
10 JOURNAL OF CHEMICAL EDUCATION 1183 3% 0% 16

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 PRINCIPAL PROPERTIES 963623 3% 100% 16 Search PRINCIPAL+PROPERTIES Search PRINCIPAL+PROPERTIES
2 QSAM 361359 1% 100% 6 Search QSAM Search QSAM
3 QUANTITATIVE SEQUENCE ACTIVITY MODEL 361359 1% 100% 6 Search QUANTITATIVE+SEQUENCE+ACTIVITY+MODEL Search QUANTITATIVE+SEQUENCE+ACTIVITY+MODEL
4 PROTEOCHEMOMETRICS 333549 2% 46% 12 Search PROTEOCHEMOMETRICS Search PROTEOCHEMOMETRICS
5 MULTIVARIATE DESIGN 303630 2% 46% 11 Search MULTIVARIATE+DESIGN Search MULTIVARIATE+DESIGN
6 MULTIVARIATE CHARACTERIZATION 226726 2% 47% 8 Search MULTIVARIATE+CHARACTERIZATION Search MULTIVARIATE+CHARACTERIZATION
7 AUGMENTED SIMPLEX DESIGN 180679 1% 100% 3 Search AUGMENTED+SIMPLEX+DESIGN Search AUGMENTED+SIMPLEX+DESIGN
8 HETEROCYCLIC AROMATICITY 180679 1% 100% 3 Search HETEROCYCLIC+AROMATICITY Search HETEROCYCLIC+AROMATICITY
9 PROBIT DOSE RESPONSE 180679 1% 100% 3 Search PROBIT+DOSE+RESPONSE Search PROBIT+DOSE+RESPONSE
10 QUANTITATIVE SEQUENCE ACTIVITY MODELING QSAM 180679 1% 100% 3 Search QUANTITATIVE+SEQUENCE+ACTIVITY+MODELING+QSAM Search QUANTITATIVE+SEQUENCE+ACTIVITY+MODELING+QSAM

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 WANG, LF , DAI, ZJ , ZHANG, HY , BAI, LY , YUAN, ZM , (2014) QUANTITATIVE SEQUENCE- ACTIVITY MODEL ANALYSIS OF OLIGOPEPTIDES COUPLING AN IMPROVED HIGH- DIMENSION FEATURE SELECTION METHOD WITH SUPPORT VECTOR REGRESSION.CHEMICAL BIOLOGY & DRUG DESIGN. VOL. 83. ISSUE 4. P. 379-391 22 63% 1
2 VAN WESTEN, GJP , SWIER, RF , WEGNER, JK , IJZERMAN, AP , VAN VLIJMEN, HWT , BENDER, A , (2013) BENCHMARKING OF PROTEIN DESCRIPTOR SETS IN PROTEOCHEMOMETRIC MODELING (PART 1): COMPARATIVE STUDY OF 13 AMINO ACID DESCRIPTOR SETS.JOURNAL OF CHEMINFORMATICS. VOL. 5. ISSUE . P. - 23 61% 4
3 YIN, JJ , DIAO, YB , WEN, ZN , WANG, ZM , LI, ML , (2010) STUDYING PEPTIDES BIOLOGICAL ACTIVITIES BASED ON MULTIDIMENSIONAL DESCRIPTORS (E) USING SUPPORT VECTOR REGRESSION.INTERNATIONAL JOURNAL OF PEPTIDE RESEARCH AND THERAPEUTICS. VOL. 16. ISSUE 2. P. 111-121 20 71% 5
4 SHANG, ZC , ZHOU, P , TIAN, FF , WU, YQ , LI, ZL , (2008) QUANTITATIVE SEQUENCE-ACTIVITY MODEL (QSAM): APPLYING QSAR STRATEGY TO MODEL AND PREDICT BIOACTIVITY AND FUNCTION OF PEPTIDES, PROTEINS AND NUCLEIC ACIDS.CURRENT COMPUTER-AIDED DRUG DESIGN. VOL. 4. ISSUE 4. P. 311 -321 44 33% 19
5 TONG, J , CHE, T , LI, Y , WANG, P , XU, X , CHEN, Y , (2011) A DESCRIPTOR OF AMINO ACIDS: SVRG AND ITS APPLICATION TO PEPTIDE QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP.SAR AND QSAR IN ENVIRONMENTAL RESEARCH. VOL. 22. ISSUE 5-6. P. 611-620 17 77% 10
6 QIAN, Y , LIANG, YN , LIU, WQ , LIANG, GZ , (2017) COMPREHENSIVE COMPARISON OF TWENTY STRUCTURAL CHARACTERIZATION SCALES APPLIED AS QSAM OF ANTIMICROBIAL DODECAPEPTIDES DERIVED FROM BAC2A AGAINST P-AERUGINOSA.JOURNAL OF MOLECULAR GRAPHICS & MODELLING. VOL. 71. ISSUE . P. 88 -95 23 50% 0
7 WANG, XY , WANG, J , LIN, Y , DING, Y , WANG, YQ , CHENG, XM , LIN, ZH , (2011) QSAR STUDY ON ANGIOTENSIN-CONVERTING ENZYME INHIBITOR OLIGOPEPTIDES BASED ON A NOVEL SET OF SEQUENCE INFORMATION DESCRIPTORS.JOURNAL OF MOLECULAR MODELING. VOL. 17. ISSUE 7. P. 1599-1606 17 71% 13
8 MEI, H , ZHOU, Y , SUN, LL , LI, ZL , (2004) A NEW DESCRIPTOR OF AMINO ACIDS AND ITS APPLICATION IN PEPTIDE QSAR.ACTA PHYSICO-CHIMICA SINICA. VOL. 20. ISSUE 8. P. 821 -825 17 81% 29
9 SANDBERG, M , ERIKSSON, L , JONSSON, J , SJOSTROM, M , WOLD, S , (1998) NEW CHEMICAL DESCRIPTORS RELEVANT FOR THE DESIGN OF BIOLOGICALLY ACTIVE PEPTIDES. A MULTIVARIATE CHARACTERIZATION OF 87 AMINO ACIDS.JOURNAL OF MEDICINAL CHEMISTRY. VOL. 41. ISSUE 14. P. 2481-2491 19 66% 269
10 TONG, JB , ZHANG, SW , (2007) A NEW 3D-DESCRIPTOR OF AMINO ACIDS AND ITS APPLICATION IN QUANTITATIVE STRUCTURE ACTIVITY RELATIONSHIP OF PEPTIDE DRUGS.ACTA PHYSICO-CHIMICA SINICA. VOL. 23. ISSUE 1. P. 37 -43 17 74% 6

Classes with closest relation at Level 1



Rank Class id link
1 13497 COMFA//MULTIDIMENSIONAL QSAR//3D QSAR
2 28178 AUTOMATED CHEMISTRY WORKSTATION//PARALLEL EXPERIMENTATION//AUTOMATED CHEMISTRY
3 33802 GRP PHARMACOCHEM//FLAGGED OBSERVATIONS//GENERALIZED REGRESSION GENETIC NEURAL NETWORK
4 3807 QSPR//QSAR//CORAL SOFTWARE
5 22568 WILLGERODT KINDLER REACTION//THIOAMIDES//THIOMORPHOLIDES
6 32335 ALLIGATOR PEAR FRUIT//ANALYSIS GENERAL//BUTTER FRUIT
7 7367 CHEM BIOACT//UNIDAD INVEST DISENO FARMACOS CONECTIVIDAD MOL//UNIV CIENCIA MOL
8 1013 LIFE SCI INFORMAT//B IT//LIMES PROGRAM UNIT CHEM BIOL MED CHEM
9 10486 IMMUNOINFORMATICS//EPITOPE PREDICTION//COMPUTATIONAL VACCINOLOGY
10 1925 MULTIVARIATE CALIBRATION//JOURNAL OF CHEMOMETRICS//CALIBRATION TRANSFER

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