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Steven L. Dixon

Schrödinger

13

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2091

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Reliable and Accurate Solution to the Induced Fit Docking Problem for Protein–Ligand Binding

2021 Journal of Chemical Theory and Computation
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Exploring conformational search protocols for ligand-based virtual screening and 3-D QSAR modeling

2015 Journal of Computer-aided Molecular Design
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Kernel-Based Partial Least Squares: Application to Fingerprint-Based QSAR with Model Visualization

2013 Journal of Chemical Information and Modeling
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Hole filling and library optimization: Application to commercially available fragment libraries

2012 Bioorganic & Medicinal Chemistry
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Analysis and comparison of 2D fingerprints: insights into database screening performance using eight fingerprint methods

2011 Journal of Cheminformatics
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Rapid Shape-Based Ligand Alignment and Virtual Screening Method Based on Atom/Feature-Pair Similarities and Volume Overlap Scoring

2011 Journal of Chemical Information and Modeling
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Large-scale systematic analysis of 2D fingerprint methods and parameters to improve virtual screening enrichments.

2010 Journal of Chemical Information and Modeling
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Analysis and comparison of 2D fingerprints: Insights into database screening performance using eight fingerprint methods

2010 Journal of Molecular Graphics & Modelling
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PHASE: a new engine for pharmacophore perception, 3D QSAR model development, and 3D database screening: 1. Methodology and preliminary results

2006 Journal of Computer-aided Molecular Design
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PHASE : A novel approach to pharmacophore modeling and 3D database searching

2006 Chemical Biology & Drug Design
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Citations (406)