Structural Bioinformatics Tools for Drug Design : Extraction of Biologically Relevant Information from Structural Databases

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Structural Bioinformatics Tools for Drug Design : Extraction of Biologically Relevant Information from Structural Databases

  • 言語:ENG
  • ISBN:9783319473871
  • eISBN:9783319473888

ファイル: /

Description

The book describes the individual steps necessary for biomacromolecular fragments analysis, as well as a list of essential software tools. For each step, it also shows corresponding web-based tools in detail and provides practical examples of their use.

All tools and databases mentioned in the examples are available free of charge, platform-independent, web-based, user-friendly and do not require a prior IT background to be fully used.

Table of Contents

1. Introduction.- 2. Biomacromolecular fragments .- 3. Databases.- 4. Detection & Extraction.- a. Biomacromolecular fragments and structural patterns.- b. channels and pores.- 5. Validation.- 6. Characterization.- a. Partial atomic charges.- b. Channel characteristics.- 7. Selected Examples.

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