Jon C. Baber
Computational Chemistry & Drug Discovery · 2009
A researcher in the Science corpus: 1 paper; trusts 2 researchers and is trusted by 0 researchers here, as inferred from the citation graph.
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- Computational Chemistry & Drug Discovery — 7 citations into it
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Papers from Jon C. Baber's perspective
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- Benchmarking sets for molecular docking.
- Glide: a new approach for rapid, accurate docking and scoring. 1. Method and assessment of docking accuracy.
- Evaluating Virtual Screening Methods: Good and Bad Metrics for the "Early Recognition" Problem
- Empirical scoring functions: I. The development of a fast empirical scoring function to estimate the binding affinity of ligands in receptor complexes
- Development and validation of a modular, extensible docking program: DOCK 5 (J. Comput. Aided Mol. Des.)
- Protein-based virtual screening of chemical databases. 1. Evaluation of different docking/scoring combinations. (Journal of Medicinal Chemistry)
- Comparison of Topological, Shape, and Docking Methods in Virtual Screening (Journal of Chemical Information and Modeling)
- Molecular docking using shape descriptors
- Recommendations for evaluation of computational methods
- Glide: a new approach for rapid, accurate docking and scoring. 2. Enrichment factors in database screening.