lammps/tools/colvarse30420fc464flammps-icms
lammps/tools/colvars
e30420fc464flammps-icms
README
README
Tools for the USER-COLVARS package
This directory contains a collection of tools for postprocessing data produced by the colvars collective variable library. To compile the tools, edit the makefile for your system and run "make".
Please report problems and issue at: https://github.com/colvars/colvars/issues
abf_integrate:
MC-based integration of multidimensional free energy gradient Version 20110511
Syntax: ./abf_integrate <filename> [-n <nsteps>] [-t <temp>] [-m [0|1] (metadynamics)] [-h <hill_height>] [-f <variable_hill_factor>]
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