DOCK Blaster:Initial Evaluation

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write about the preliminary docking calculations. This is a description of the diagnositcs during preliminary docking that are available depending on the inputs.

Contents

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Overview

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Case: NO Ligand Supplied

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Case: Ligand Supplied as mol2

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Case: Actives supplied

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Case: Inactives also supplied

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Interpretation of Similars

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Interpretation of Dissimilars

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Interpretation of Extrema

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