Austin B. Yongye

According to our database, Austin B. Yongye authored at least 10 papers between 2007 and 2013.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2013

Rapid Scanning Structure-Activity Relationships in Combinatorial Data Sets: Identification of Activity Switches.

José L. Medina-Franco, Bruce S. Edwards, Clemencia Pinilla, Jon R. Appel, Marc A. Giulianotti, Radleigh Santos, Austin B. Yongye, Larry A. Sklar, Richard A. Houghten

J. Chem. Inf. Model., 2013

2012

Data Mining of Protein-Binding Profiling Data Identifies Structural Modifications that Distinguish Selective and Promiscuous Compounds.

Austin B. Yongye, José L. Medina-Franco

J. Chem. Inf. Model., 2012

Activity-difference maps and consensus similarity measure characterize structure-activity relationships.

José L. Medina-Franco, Austin B. Yongye, Jaime Pérez-Villanueva, Richard A. Houghten, Karina Martínez-Mayorga

J. Cheminformatics, 2012

A large scale classification of molecular fingerprints for the chemical space representation and SAR analysis.

Fabian López-Vallejo, Jacob Waddell, Austin B. Yongye, Richard A. Houghten, José L. Medina-Franco

J. Cheminformatics, 2012

2011

Consensus Models of Activity Landscapes with Multiple Chemical, Conformer, and Property Representations.

Austin B. Yongye, Kendall G. Byler, Radleigh Santos, Karina Martínez-Mayorga, Gerald M. Maggiora, José L. Medina-Franco

J. Chem. Inf. Model., 2011

Multitarget Structure-Activity Relationships Characterized by Activity-Difference Maps and Consensus Similarity Measure.

José L. Medina-Franco, Austin B. Yongye, Jaime Pérez-Villanueva, Richard A. Houghten, Karina Martínez-Mayorga

J. Chem. Inf. Model., 2011

2010

Conformational landscape of platinum(II)-tetraamine complexes: DFT and NBO studies.

Austin B. Yongye, Marc A. Giulianotti, Adel Nefzi, Richard A. Houghten, Karina Martínez-Mayorga

J. Comput. Aided Mol. Des., 2010

Dynamic clustering threshold reduces conformer ensemble size while maintaining a biologically relevant ensemble.

Austin B. Yongye, Andreas Bender, Karina Martínez-Mayorga

J. Comput. Aided Mol. Des., 2010

2009

Modeling of peptides containing D-amino acids: implications on cyclization.

Austin B. Yongye, Yangmei Li, Marc A. Giulianotti, Yongping Yu, Richard A. Houghten, Karina Martínez-Mayorga

J. Comput. Aided Mol. Des., 2009

2007

GLYCAM06: A generalizable biomolecular force field. Carbohydrates.

Karl Nicholas Kirschner, Austin B. Yongye, Sarah M. Tschampel, Jorge González-Outeiriño, Charlisa R. Daniels, Bethany Lachele Foley, Robert J. Woods

J. Comput. Chem., 2007