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MCCE2.2 and MCCE2.0 WebView

A newer version of MCCE is available on Here

To download MCCE2.2 and MCCE2.0 WebView for Linux and Mac OSX, please fill in the following information:

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Energy table handling tool - zopp:

MCCE uses a compressed file energies.opp to store energy lookup table. The tool allows you to decompress the file to a viewable format, or merge multiple partial step 3 runs.
zopp

Preconfigured run control files:

MCCE can run at various rotamer levels. The best result is achieved when a proper rotamer making and optimization strategies are seletced. Here are a few examples of "run.prm" files designed for different calculation porpose.

To use these files, copy the file to your working directory, rename the file as "run.prm" and replace MCCE_INSTALLATION with the path of your mcce program.

run.prm.quick (Last update: 08/10/2006)

run.prm.pka (Last update: 08/10/2006)

run.prm.default (Last update: 08/10/2006)

run.prm.full (Last update: 08/10/2006)

Cofactor parameter (topology) files:

MCCE relies on the parameter (tpl) file to recognize a residue or cofactor. The atoms, bonds, charges, radii, and other chemical and physical properties of a cofactor are defined in such a file, usually one file per cofator.

To include a new tpl file into your MCCE parameter directory, save the file to the MCCE installation directory under param directory of the correct dielectric constant.

Description
param04
param08
Magisium ion, two ionization states (+2 charged and dummy)