Using the Discover Program in the Insight Interface - Tutorial

These lessons introduce you to the commands and functionalities of the Discover_3 module. The lessons assume that you already have some familiarity with the Insight interface (please see the Insight documentation for relevant tutorials).

These tutorials also exist in the form of Pilot logfiles, which can be run from within the Insight interface and will execute the commands for you. You may prefer to use them.

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Introductions to the Tutorial Lessons
Direct Access to the Tutorial Lessons

More tutorials, which emphasize use of the BTCL commands.

Setting up To Run Tutorials

Introductions to the Tutorial Lessons

Minimizing a molecule
Simple dynamics with equilibration and data-collection stages
Restarting a dynamics calculation
Constant-stress dynamics and controlling background jobs
Generating a phi/psi map
Using a precoded BTCL script for a complex simulation

Direct Access to the Tutorial Lessons

Minimizing a molecule
Simple dynamics with equilibration and data-collection stages
Restarting a dynamics calculation
Constant-stress dynamics and controlling background jobs
Generating a phi/psi map
Using a precoded BTCL script for a complex simulation

Main access page

Insight UIF access.