Alexander Golbraikh

19 papers Journal 19

Year	Rank	Type	Title / Venue / Authors
2018	J	`jnl`	Multi-Descriptor Read Across (MuDRA): A Simple and Transparent Approach for Developing Accurate Quantitative Structure-Activity Relationship Models. J. Chem. Inf. Model. 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
2014	J	`jnl`	Application of Quantitative Structure-Activity Relationship Models of 5-HT J. Chem. Inf. Model. Man Luo, Xiang Simon Wang, Bryan L. Roth, Alexander Golbraikh, Alexander Tropsha
2014	J	`jnl`	Data Set Modelability by QSAR. J. Chem. Inf. Model. Alexander Golbraikh, Eugene N. Muratov, Denis Fourches, Alexander Tropsha
2013	J	`jnl`	Discovery of Novel Antimalarial Compounds Enabled by QSAR-Based Virtual Screening. J. Chem. Inf. Model. 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
2012	J	`jnl`	Does Rational Selection of Training and Test Sets Improve the Outcome of QSAR Modeling? J. Chem. Inf. Model. Todd M. Martin, Paul Harten, Douglas M. Young, Eugene N. Muratov, Alexander Golbraikh, Hao Zhu, Alexander Tropsha
2008	J	`jnl`	Combinatorial QSAR Modeling of Specificity and Subtype Selectivity of Ligands Binding to Serotonin Receptors 5HT1E and 5HT1F. J. Chem. Inf. Model. Xiang S. Wang, Hao Tang, Alexander Golbraikh, Alexander Tropsha
2008	J	`jnl`	Differentiation of AmpC beta-lactamase binders vs. decoys using classification J. Comput. Aided Mol. Des. Jui-Hua Hsieh, Xiang S. Wang, Denise G. Teotico, Alexander Golbraikh, Alexander Tropsha
2006	J	`jnl`	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. Shuxing Zhang, Alexander Golbraikh, Scott Oloff, Harold Kohn, Alexander Tropsha
2006	J	`jnl`	Combinatorial QSAR Modeling of P-Glycoprotein Substrates. J. Chem. Inf. Model. Patricia de Cerqueira Lima, Alexander Golbraikh, Scott Oloff, Yunde Xiao, Alexander Tropsha
2005	J	`jnl`	Quantitative Structure-activity Relationship Analysis of Pyridinone HIV-1 Reverse Transcriptase Inhibitors using the J. Comput. Aided Mol. Des. José L. Medina-Franco, Alexander Golbraikh, Scott Oloff, Rafael Castillo, Alexander Tropsha
2004	J	`jnl`	Combinatorial QSAR of Ambergris Fragrance Compounds. J. Chem. Inf. Model. Assia Kovatcheva, Alexander Golbraikh, Scott Oloff, Yun-De Xiao, Weifan Zheng, Peter Wolschann, Gerhard Buchbauer, Alexander Tropsha
2003	J	`jnl`	QSAR Modeling Using Chirality Descriptors Derived from Molecular Topology. J. Chem. Inf. Comput. Sci. Alexander Golbraikh, Alexander Tropsha
2003	J	`jnl`	QSAR Modeling of alpha-Campholenic Derivatives with Sandalwood Odor. J. Chem. Inf. Comput. Sci. Assia Kovatcheva, Gerhard Buchbauer, Alexander Golbraikh, Peter Wolschann
2003	J	`jnl`	Rational selection of training and test sets for the development of validated QSAR models. J. Comput. Aided Mol. Des. Alexander Golbraikh, Min Shen, Zhiyan Xiao, Yun-De Xiao, Kuo-Hsiung Lee, Alexander Tropsha
2002	J	`jnl`	Novel ZE-Isomerism Descriptors Derived from Molecular Topology and Their Application to QSAR Analysis. J. Chem. Inf. Comput. Sci. Alexander Golbraikh, Danail Bonchev, Alexander Tropsha
2002	J	`jnl`	Predictive QSAR modeling based on diversity sampling of experimental datasets for the training and test set selection. J. Comput. Aided Mol. Des. Alexander Golbraikh, Alexander Tropsha
2001	J	`jnl`	Novel Chirality Descriptors Derived from Molecular Topology. J. Chem. Inf. Comput. Sci. Alexander Golbraikh, Danail Bonchev, Alexander Tropsha
2000	J	`jnl`	Molecular Dataset Diversity Indices and Their Applications to Comparison of Chemical Databases and QSAR Analysis. J. Chem. Inf. Comput. Sci. Alexander Golbraikh
1993	J	`jnl`	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. Monika Tarnowska, Adam Liwo, Mark D. Shenderovich, Inta Liepina, Alexander Golbraikh, Zbigniew Grzonka, Anna Tempczyk