Emilio Xavier Esposito

Publication Activity (10 Years)

Years Active: 2008-2013
Publications (10 Years): 0

Top Topics

Image Descriptors

Heterogeneous Data Sets

Top Venues

J. Chem. Inf. Model.

J. Comput. Aided Mol. Des.

Publications

Chi-Yu Shao, Sing-Zuo Chen, Bo-Han Su, Yufeng J. Tseng, Emilio Xavier Esposito, Anton J. Hopfinger
Dependence of QSAR Models on the Selection of Trial Descriptor Sets: A Demonstration Using Nanotoxicity Endpoints of Decorated Nanotubes. J. Chem. Inf. Model. 53 (1) (2013)
James B. Dunbar Jr., Richard D. Smith, Kelly L. Damm-Ganamet, Aqeel Ahmed, Emilio Xavier Esposito, James Delproposto, Krishnapriya Chinnaswamy, You-Na Kang, Ginger Kubish, Jason E. Gestwicki, Jeanne A. Stuckey, Heather A. Carlson
CSAR Data Set Release 2012: Ligands, Affinities, Complexes, and Docking Decoys. J. Chem. Inf. Model. 53 (8) (2013)
Chia-Yun Chang, Ming-Tsung Hsu, Emilio Xavier Esposito, Yufeng J. Tseng
Oversampling to Overcome Overfitting: Exploring the Relationship between Data Set Composition, Molecular Descriptors, and Predictive Modeling Methods. J. Chem. Inf. Model. 53 (4) (2013)
Yufeng J. Tseng, Anton J. Hopfinger, Emilio Xavier Esposito
The great descriptor melting pot: mixing descriptors for the common good of QSAR models. J. Comput. Aided Mol. Des. 26 (1) (2012)
Bo-Han Su, Yi-shu Tu, Emilio Xavier Esposito, Yufeng J. Tseng
End Point Predictions. J. Chem. Inf. Model. 52 (6) (2012)
Richard D. Smith, James B. Dunbar Jr., Peter Man-Un Ung, Emilio Xavier Esposito, Chao-Yie Yang, Shaomeng Wang, Heather A. Carlson
CSAR Benchmark Exercise of 2010: Combined Evaluation Across All Submitted Scoring Functions. J. Chem. Inf. Model. 51 (9) (2011)
Bo-Han Su, Meng-yu Shen, Emilio Xavier Esposito, Anton J. Hopfinger, Yufeng J. Tseng
In Silico Binary Classification QSAR Models Based on 4D-Fingerprints and MOE Descriptors for Prediction of hERG Blockage. J. Chem. Inf. Model. 50 (7) (2010)
Anton J. Hopfinger, Emilio Xavier Esposito, Antonio Llinàs, Robert C. Glen, Jonathan M. Goodman
Findings of the Challenge To Predict Aqueous Solubility. J. Chem. Inf. Model. 49 (1) (2009)
Tao Zheng, Anton J. Hopfinger, Emilio Xavier Esposito, Jianzhong Liu, Yufeng J. Tseng
Membrane-Interaction Quantitative Structure-Activity Relationship (MI-QSAR) Analyses of Skin Penetration Enhancers. J. Chem. Inf. Model. 48 (6) (2008)
Jianzhong Liu, Petra Kern, G. Frank Gerberick, Osvaldo Andrade Santos-Filho, Emilio Xavier Esposito, Anton J. Hopfinger, Yufeng J. Tseng
Categorical QSAR models for skin sensitization based on local lymph node assay measures and both ground and excited state 4D-fingerprint descriptors. J. Comput. Aided Mol. Des. 22 (6-7) (2008)