Tinker9 User Manual
Introduction
Installation
Tutorials
Features & Methods
Electrostatics
Keywords
References
Index Page
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Tinker9 User Manual
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Contents
Introduction
Installation
Prerequisites
Download the Canonical Tinker
Build Tinker9 with CMake
Tutorials
Common File Types
Command Line GUI
Program: analyze
Program: minimize
Program: dynamic
Features & Methods
Valence Potential Functions
Van der Waals Potential Functions
Integrators and Ensembles
Electrostatics
Permanent Multipole
Induced Dipole
Quasi-Internal Frame
Keywords
Valence Potentials
Constraints & Restraints
HIPPO Force Field
Molecular Dynamics and Ensembles
Free Energy
Parallelization
Mathematical Algorithms
References
References
Index
Index Page
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Introduction