AMMOS 2 – Automated Molecular Mechanics Optimization tool for in silico Screening / using Distance Geometry

AMMOS 2

:: DESCRIPTION

AMMOS  (Automatic Molecular Mechanics Optimization for in silico Screening) employs an automatic procedure for energy minimization of protein-ligands complexes.

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::DEVELOPER

Molécules Thérapeutiques in silico (MTi)

:: SCREENSHOTS

N/A

::REQUIREMENTS

  • Web Server

:: DOWNLOAD

NO

:: MORE INFORMATION

Citation

Labbé CM, Pencheva T, Jereva D, Desvillechabrol D, Becot J, Villoutreix BO, Pajeva I, Miteva MA.
AMMOS2: a web server for protein-ligand-water complexes refinement via molecular mechanics.
Nucleic Acids Res. 2017 May 9.

BMC Bioinformatics. 2008 Oct 16;9:438. doi: 10.1186/1471-2105-9-438.
AMMOS: Automated Molecular Mechanics Optimization tool for in silico Screening.
Pencheva T, Lagorce D, Pajeva I, Villoutreix BO, Miteva MA.

BMC Chem Biol. 2009 Nov 13;9:6. doi: 10.1186/1472-6769-9-6.
DG-AMMOS: a new tool to generate 3d conformation of small molecules using distance geometry and automated molecular mechanics optimization for in silico screening.
Lagorce D, Pencheva T, Villoutreix BO, Miteva MA.