18 lines
595 B
Plaintext
18 lines
595 B
Plaintext
=== 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>]
|
|
|