ERmod

Approximate solvation free energy calculator

Add a Review
2 Downloads (This Week)
Last Update:
Download ermod-0.2.4.tar.gz
Browse All Files
BSD Linux

Description

ERmod (Energy Representation Module) is a program to calculate the solvation free energy based on the energy representation method (J. Chem. Phys. 113, 6070 (2000)). The program allows users to calculate the solvation free energy to arbitrary solvents, including inhomogeneous systems, and can run in cooperation with state-of-art molecular simulation softwares, such as NAMD, GROMACS and/or AMBER.

ERmod Web Site

Update Notifications





Write a Review

User Reviews

Be the first to post a review of ERmod!

Additional Project Details

Intended Audience

End Users/Desktop, Science/Research

User Interface

Command-line

Programming Language

Fortran, Python

Registered

2012-02-14
Screenshots can attract more users to your project.
Features can attract more users to your project.

Icons must be PNG, GIF, or JPEG and less than 1 MiB in size. They will be displayed as 48x48 images.