Alexander Golbraikh

Publication Activity (10 Years)

Years Active: 1993-2018
Publications (10 Years): 1

Top Topics

Virtual Screening

Systems Biology

Chemical Compounds

Top Venues

J. Chem. Inf. Model.

Publications

Vinicius M. Alves, Alexander Golbraikh, Stephen J. Capuzzi, Kammy Liu, Wai In Lam, Daniel Robert Korn, Diane Pozefsky, Carolina Horta Andrade, Eugene N. Muratov, Alexander Tropsha
Multi-Descriptor Read Across (MuDRA): A Simple and Transparent Approach for Developing Accurate Quantitative Structure-Activity Relationship Models. J. Chem. Inf. Model. 58 (6) (2018)
Alexander Golbraikh, Eugene N. Muratov, Denis Fourches, Alexander Tropsha
Data Set Modelability by QSAR. J. Chem. Inf. Model. 54 (1) (2014)
Man Luo, Xiang Simon Wang, Bryan L. Roth, Alexander Golbraikh, Alexander Tropsha
Ligands. J. Chem. Inf. Model. 54 (2) (2014)
Liying Zhang, Denis Fourches, Alexander Sedykh, Hao Zhu, Alexander Golbraikh, Sean Ekins, Julie Clark, Michele C. Connelly, Martina Sigal, Dena Hodges, Armand Guiguemde, R. Kiplin Guy, Alexander Tropsha
Discovery of Novel Antimalarial Compounds Enabled by QSAR-Based Virtual Screening. J. Chem. Inf. Model. 53 (2) (2013)
Todd Martin, Paul Harten, Douglas M. Young, Eugene N. Muratov, Alexander Golbraikh, Hao Zhu, Alexander Tropsha
Does Rational Selection of Training and Test Sets Improve the Outcome of QSAR Modeling? J. Chem. Inf. Model. 52 (10) (2012)
Xiang S. Wang, Hao Tang, Alexander Golbraikh, Alexander Tropsha
Combinatorial QSAR Modeling of Specificity and Subtype Selectivity of Ligands Binding to Serotonin Receptors 5HT1E and 5HT1F. J. Chem. Inf. Model. 48 (5) (2008)
Jui-Hua Hsieh, Xiang S. Wang, Denise G. Teotico, Alexander Golbraikh, Alexander Tropsha
NN QSAR modeling and application of the QSAR classifier to virtual screening. J. Comput. Aided Mol. Des. 22 (9) (2008)
Patricia de Cerqueira Lima, Alexander Golbraikh, Scott Oloff, Yunde Xiao, Alexander Tropsha
Combinatorial QSAR Modeling of P-Glycoprotein Substrates. J. Chem. Inf. Model. 46 (3) (2006)
Shuxing Zhang, Alexander Golbraikh, Scott Oloff, Harold Kohn, Alexander Tropsha
A Novel Automated Lazy Learning QSAR (ALL-QSAR) Approach: Method Development, Applications, and Virtual Screening of Chemical Databases Using Validated ALL-QSAR Models. J. Chem. Inf. Model. 46 (5) (2006)
José L. Medina-Franco, Alexander Golbraikh, Scott Oloff, Rafael Castillo, Alexander Tropsha
Nearest Neighbor Method and QSAR-based Database Mining. J. Comput. Aided Mol. Des. 19 (4) (2005)
Assia Kovatcheva, Alexander Golbraikh, Scott Oloff, Yun-De Xiao, Weifan Zheng, Peter Wolschann, Gerhard Buchbauer, Alexander Tropsha
Combinatorial QSAR of Ambergris Fragrance Compounds. J. Chem. Inf. Model. 44 (2) (2004)
Assia Kovatcheva, Gerhard Buchbauer, Alexander Golbraikh, Peter Wolschann
QSAR Modeling of alpha-Campholenic Derivatives with Sandalwood Odor. J. Chem. Inf. Comput. Sci. 43 (1) (2003)
Alexander Golbraikh, Min Shen, Zhiyan Xiao, Yun-De Xiao, Kuo-Hsiung Lee, Alexander Tropsha
Rational selection of training and test sets for the development of validated QSAR models. J. Comput. Aided Mol. Des. 17 (2-4) (2003)
Alexander Golbraikh, Alexander Tropsha
QSAR Modeling Using Chirality Descriptors Derived from Molecular Topology. J. Chem. Inf. Comput. Sci. 43 (1) (2003)
Alexander Golbraikh, Danail Bonchev, Alexander Tropsha
Novel ZE-Isomerism Descriptors Derived from Molecular Topology and Their Application to QSAR Analysis. J. Chem. Inf. Comput. Sci. 42 (4) (2002)
Alexander Golbraikh, Alexander Tropsha
Predictive QSAR modeling based on diversity sampling of experimental datasets for the training and test set selection. J. Comput. Aided Mol. Des. 16 (5-6) (2002)
Alexander Golbraikh, Danail Bonchev, Alexander Tropsha
Novel Chirality Descriptors Derived from Molecular Topology. J. Chem. Inf. Comput. Sci. 41 (1) (2001)
Alexander Golbraikh
Molecular Dataset Diversity Indices and Their Applications to Comparison of Chemical Databases and QSAR Analysis. J. Chem. Inf. Comput. Sci. 40 (2) (2000)
Monika Tarnowska, Adam Liwo, Mark D. Shenderovich, Inta Liepina, Alexander Golbraikh, Zbigniew Grzonka, Anna Tempczyk
A molecular mechanics study of the effect of substitution in position 1 on the conformational space of the oxytocin/vasopressin ring. J. Comput. Aided Mol. Des. 7 (6) (1993)