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内部出版物
Wiley电子期刊(1)
SpringerLink电子期刊(10)
Elsevier电子期刊(19)
ACS电子期刊(2)
在“
Elsevier电子期刊
”中,
命中:
19
条,耗时:小于0.01 秒
在所有数据库中总计命中:
32
条
1.
Which structural features stand behind micelization of ionic liquids? Quantitative Structure-Property Relationship studies
作者:
Maciej Barycki
;
Anita Sosnowska
;
Tomasz Puzyn
;
t.puzyn@qsar.eu.org" class="auth_mail" title="E-mail the corresponding author
关键词:
QSPR
;
Quantitative Structure-Property Relationship
;
IL
;
ionic liquid
;
CMC
;
critical micelization concentration
;
GETAWAY
;
GEometry
;
Topology
;
and Atom-Weights AssemblY
descriptors
;
IFT
;
interferential tension measurement
;
ST
;
surface tension measurement
;
EC
;
electric conductivity measurement
;
GA
;
Genetic Algorithm
;
MLR
;
Multiple Linear Regression
;
R2/Q2
;
determination coefficient
;
CCC
;
Concordance Correlation Coefficient
;
RMSE
;
Root Mean Square Error
;
MAE
;
Mean Average Error
;
AD
;
applicability do
刊名:Journal of Colloid and Interface Science
出版年:2017
2.
Quantitative structure–retention relationships of pesticides in reversed-phase high-performance liquid chromatography based on WHIM and
GETAWAY
molecular
descriptors
作者:
Angelo Antonio D’
;
Archivio
;
Maria Anna Maggi
;
Pietro Mazzeo
;
Fabrizio Ruggieri
关键词:
Reversed-phase high-performance liquid chromatography
;
Retention models
;
Artificial neural network
;
WHIM
descriptors
;
GETAWAY
descriptors
;
Pesticides
刊名:Analytica Chimica Acta
出版年:2008
3.
Quantitative structure–activity relationship studies of HIV-1 integrase inhibition. 1.
GETAWAY
descriptors
作者:
Liane Saí
;
z-Urra
;
Maykel Pé
;
rez Gonzá
;
lez
;
Yagamare Fall
;
Generosa Gó
;
mez
关键词:
QSAR
;
HIV-1 integrase inhibitors
;
GETAWAY
descriptors
刊名:European Journal of Medicinal Chemistry
出版年:2007
4.
Adsorption of s-triazines onto polybenzimidazole: A quantitative structure–property relationship investigation
作者:
Angelo Antonio D’
;
Archivio
;
Angela Incani
;
Pietro Mazzeo
;
Fabrizio Ruggieri
关键词:
Triazines
;
Polybenzimidazole
;
Adsorption isotherms
;
Quantitative structure–
;
property relationship
;
Molecular
descriptors
刊名:Analytica Chimica Acta
出版年:2009
5.
GETAWAY
descriptors
to predicting A
2A
adenosine receptors agonists
作者:
M.P. Gonzá
;
lez
;
C. Terá
n ;
M. Teijeira
;
M.J. Gonzá
;
lez-Moa
关键词:
QSAR
;
A
2A
adenosine receptors agonists
;
GETAWAY
descriptors
刊名:European Journal of Medicinal Chemistry
出版年:2005
6.
Geometry, topology, and atom-weights assembly
descriptors
to predicting A
1
adenosine receptors agonists
作者:
Gonz??lez
;
Maykel P??rez
;
Ter??n
;
Carmen
;
Teijeira
;
Marta
;
Besada
;
Pedro
关键词:
QSAR
;
A
1
adenosine receptors agonists
;
GETAWAY
descriptors
刊名:Bioorganic & Medicinal Chemistry Letters
出版年:2005
7.
Computational modeling tools for the design of potent antimalarial bisbenzamidines: Overcoming the antimalarial potential of pentamidine
作者:
Maykel Cruz-Monteagudo
;
Fern
;
a Borges
;
Maykel Perez Gonzá
;
lez
;
M. Natá
;
lia Dias Soeiro Cordeiro
关键词:
Antimalarial
;
Bisbenzamidines
;
GETAWAY
descriptors
;
QSAR
刊名:Bioorganic and Medicinal Chemistry
出版年:2007
8.
QSAR modeling of the rodent carcinogenicity of nitrocompounds
作者:
Aliuska Morales Helguera
;
M. Natá
;
lia D.S. Cordeiro
;
Miguel Á
;
ngel Cabrera Pé
;
rez
;
Robert D. Combes
;
Maykel Pé
;
rez Gonzá
;
lez
关键词:
Nitrocompounds
;
GETAWAY
;
Carcinogenicity
;
QSAR
;
Genetic Algorithm
刊名:Bioorganic and Medicinal Chemistry
出版年:2008
9.
QSAR study of antioxidant activity of wine polyphenols
作者:
Vesna Rastija
;
Marica Medić
;
-Š
;
arić
关键词:
Polyphenols
;
Wine
;
Antioxidant activity
;
QSAR
刊名:European Journal of Medicinal Chemistry
出版年:2009
10.
Radial distribution function
descriptors
: an alternative for predicting A
2 A
adenosine receptors agonists
作者:
Maykel Pé
;
rez Gonzá
;
lez
;
Carmen Terá
n ;
Marta Teijeira
;
Aliuska Morales Helguera
关键词:
QSAR
;
A
2
;
A adenosine receptors agonists
;
RDF
descriptors
刊名:European Journal of Medicinal Chemistry
出版年:2006
1
2
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