TY  - JOUR
A1  - Alves, V M
A1  - Muratov, E 
A1  - Fourches, D 
A1  - Strickland, J 
A1  - Kleinstreuer, N 
A1  - Andrade, C H
A1  - Tropsha, A 
T1  - Predicting chemically-induced skin reactions. Part I: QSAR models of skin sensitization and their application to identify potentially hazardous compounds.
Y1  - 2015/04/15
N1  - R833825
N1  - R835166
VL  - 284
IS  - 2
SP  - 262
EP  - 272
ER  - 


TY  - JOUR
A1  - Alves, V M
A1  - Muratov, E 
A1  - Fourches, D 
A1  - Strickland, J 
A1  - Kleinstreuer, N 
A1  - Andrade, C H
A1  - Tropsha, A 
T1  - Predicting chemically-induced skin reactions. Part II: QSAR models of skin permeability and the relationships between skin permeability and skin sensitization.
Y1  - 2015/04/15
N1  - R833825
N1  - R835166
VL  - 284
IS  - 2
SP  - 273
EP  - 280
ER  - 


TY  - JOUR
A1  - Borysov, P 
A1  - Hannig, J 
A1  - Marron, J S
A1  - Muratov, E 
A1  - Fourches, D 
A1  - Tropsha, A 
T1  - Activity prediction and identification of mis-annotated chemical compounds using extreme descriptors.
Y1  - 2016/03/
N1  - R833825
N1  - R832720
JF  - JOURNAL OF CHEMOMETRICS
J1  - J CHEMOMETR
VL  - 30
IS  - 3
SP  - 99
EP  - 108
ER  - 


TY  - JOUR
A1  - Fourches, D 
A1  - Barnes, J C
A1  - Day, N C
A1  - Bradley, P 
A1  - Reed, J Z
A1  - Tropsha, A 
T1  - Cheminformatics analysis of assertions mined from literature that describe drug-induced liver injury in different species.
Y1  - 2010/01/
N1  - R833825
N1  - R832720
JF  - CHEMICAL RESEARCH TOXICOLOGY
VL  - 23
IS  - 1
SP  - 171
EP  - 183
ER  - 


TY  - JOUR
A1  - Fourches, D 
A1  - Muratov, E 
A1  - Tropsha, A 
T1  - Trust, but verify: on the importance of chemical structure curation in cheminformatics and QSAR modeling research.
Y1  - 2010/07/26
N1  - R833825
N1  - R832720
JF  - JOURNAL OF CHEMICAL INFORMATION AND MODELING
J1  - Journal of Chemical Information and Modeling
J2  - Journal of Chemical Information and Modeling
VL  - 50
IS  - 7
SP  - 1189
EP  - 1204
ER  - 


TY  - JOUR
A1  - Fourches, D 
A1  - Muratov, E 
A1  - Ding, F 
A1  - Dokholyan, N V
A1  - Tropsha, A 
T1  - Predicting binding affinity of CSAR ligands using both structure-based and ligand-based approaches.
Y1  - 2013/08/26
N1  - R833825
N1  - R832720
JF  - JOURNAL OF CHEMICAL INFORMATION AND MODELING
J1  - Journal of Chemical Information and Modeling
J2  - Journal of Chemical Information and Modeling
VL  - 53
IS  - 8
SP  - 1915
EP  - 1922
ER  - 


TY  - JOUR
A1  - Ham, J 
A1  - Sun, W 
T1  - Partial correlation matrix estimation using ridge penalty followed by thresholding and re-estimation.
Y1  - 2014/09/
N1  - R833825
JF  - BIOMETRICS
J1  - BIOMETRICS
VL  - 70
IS  - 3
SP  - 765
EP  - 773
ER  - 


TY  - JOUR
A1  - Low, Y S
A1  - Sedykh, A Y
A1  - Rusyn, I 
A1  - Tropsha, A 
T1  - Integrative approaches for predicting in vivo effects of chemicals from their structural descriptors and the results of short-term biological assays.
Y1  - 2014//
N1  - R833825
N1  - R832720
N1  - R835166
VL  - 14
IS  - 11
SP  - 1356
EP  - 1364
ER  - 


TY  - JOUR
A1  - Muratov, E N
A1  - Varlamova, E V
A1  - Artemenko, A G
A1  - Khristova, T 
A1  - Kuz'min, V E
A1  - Makarov, V A
A1  - Riabova, O B
A1  - Wutzler, P 
A1  - Schmidtke, M 
T1  - QSAR analysis of (biphenyloxy)propyl isoxazoles: agents against coxsackievirus B3.
Y1  - 2011/01/
N1  - R833825
N1  - R832720
JF  - FUTURE MEDICINAL CHEMISTRY
VL  - 3
IS  - 1
SP  - 15
EP  - 27
ER  - 


TY  - JOUR
A1  - Muratov, E N
A1  - Varlamova, E V
A1  - Artemenko, A G
A1  - Polishchuk, P G
A1  - Kuz'min, V E
T1  - Existing and developing approaches for QSAR analysis of mixtures.
Y1  - 2012/04/
N1  - R833825
N1  - R832720
JF  - MOLECULAR INFORMATICS
VL  - 31
IS  - 3-4
SP  - 202
EP  - 221
ER  - 


TY  - JOUR
A1  - Muratov, E N
A1  - Varlamova, E V
A1  - Artemenko, A G
A1  - Polishchuk, P G
A1  - Nikolaeva-Glomb, L 
A1  - Galabov, A S
A1  - Kuz'min, V E
T1  - QSAR analysis of poliovirus inhibition by dual combinations of antivirals.
Y1  - 2013/10/
N1  - R833825
N1  - R832720
JF  - STRUCTURAL CHEMISTRY
J1  - STRUCT CHEM
VL  - 24
IS  - 5
SP  - 1665
EP  - 1679
ER  - 


TY  - JOUR
A1  - Politi, R 
A1  - Rusyn, I 
A1  - Tropsha, A 
T1  - Prediction of binding affinity and efficacy of thyroid hormone receptor ligands using QSAR and structure-based modeling methods.
Y1  - 2014/10/1
N1  - R833825
N1  - R835166
JF  - TOXICOLOGY AND APPLIED PHARMACOLOGY
J1  - TOXICOL APPL PHARM
J2  - Toxicol.Appl.Pharmacol.
J3  - Toxicol Appl Pharmacol
J4  - Toxicology and Applied Pharmacology
VL  - 280
IS  - 1
SP  - 177
EP  - 189
ER  - 


TY  - JOUR
A1  - Sun, W 
A1  - Li, L 
T1  - Multiple loci mapping via model-free variable selection.
Y1  - 2012/03/
N1  - R833825
JF  - BIOMETRICS
J1  - BIOMETRICS
VL  - 68
IS  - 1
SP  - 12
EP  - 22
ER  - 


TY  - JOUR
A1  - Zhang, L 
A1  - Sedykh, A 
A1  - Tripathi, A 
A1  - Zhu, H 
A1  - Afantitis, A 
A1  - Mouchlis, V D
A1  - Melagraki, G 
A1  - Rusyn, I 
A1  - Tropsha, A 
T1  - Identification of putative estrogen receptor-mediated endocrine disrupting chemicals using QSAR- and structure-based virtual screening approaches.
Y1  - 2013/10/1
N1  - R833825
N1  - R835166
VL  - 272
IS  - 1
SP  - 67
EP  - 76
ER  - 


TY  - JOUR
A1  - Zhang, X 
A1  - Huang, S 
A1  - Sun, W 
A1  - Wang, W 
T1  - Rapid and robust resampling-based multiple-testing correction with application in a genome-wide expression quantitative trait loci study.
Y1  - 2012/04/
N1  - R833825
JF  - GENETICS
J1  - GENETICS
VL  - 190
IS  - 4
SP  - 1511
EP  - 1520
ER  - 


TY  - CONF
A1  - Abdo, N 
A1  - Xia, M 
A1  - Kosyk, O 
A1  - Huang, R 
A1  - Sakamuru, S 
A1  - Brown, C 
T1  - The 1000 genomes toxicity screening project: utilizing the power of human genome variation for population-scale <em>in vitro</em> testing.
Y1  - 2013/03/10-14
N1  - R833825
N1  - R835166
ER  -