.. _abbreviations:

Abbreviations
=============

.. list-table:: abbreviations
    :widths: 30 100
    :header-rows: 1

    * - abbreviation
      - definition
    * - SQM
      - semiempirical quantum mechanical (method)
    * - ALPB
      - analytical linearized Poisson-Boltzmann model
    * - GBSA
      - generalized born surface approximation
    * - DFT
      - density functional theory
    * - DFA
      - density functional approximation
    * - FF
      - force field
    * - CREST
      - conformer rotamer ensemble search tool
    * - CENSO
      - command-line energetic sorting
    * - NMR
      - nuclear magnetic resonance
    * - OR
      - optical rotatory dispersion
    * - GFN
      - Geometry Frequency Noncovalent 
    * - GCP
      - geometric counterpoise correction