AMBER

AMBER is a suite of programs that allow users to perform molecular dynamics simulations, on biomolecules.

AMBER V4.1 (1994) represents significant development over version 4.0 (1991). The differences include:

* updated forcefield for proteins and nucleic acids

* faster algorithms for simulations with water

* parallelized dynamics codes

* new algorithms for free energy simulations, including support for forcefields with polarization terms

* new graphical tools for preparing input to the dynamics programs

* powerful tools for NMR spectral simulations

* a new program for fitting point electrostatic charges from quantum data

Further information is available from http//www.amber.ucsf.edu/.

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Oxford Molecular Group, Inc.
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