helloyesterday / PLUMED2_ITS

The integrated tempering sampling as a bias in PLUMED2

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PLUMED2_ITS

The integrated tempering sampling (ITS) method as a bias in PLUMED2.

This project only includes the basic code of ITS method. Please download PLUMED2 from website http://www.plumed.org/

This problem is based on PLUMED 2.4, and it could also be used with PLUMED 2.3.

All the codes are in the src/bias directory. In order to use the ITS method, please copy them to the (plumed_path)/src/bias directory and recompile PLUMED2.

You can also download the merged full version of PLUMED 2 in my project helloyesterday/plumed2 with the branch "ver_isaac". That branch includes all the modified function of PLUMED2 at my GitHub account.

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The integrated tempering sampling as a bias in PLUMED2

License:GNU General Public License v3.0


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