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ringclosingmm

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Ring closing molecular modeling using an OpenMM engine

Installation

To install this package, run one of the following:

Conda
$conda install denoptim-project::ringclosingmm

Usage Tracking

1.0.1
1.0.0
2 / 8 versions selected
Total downloads: 0

Description

The RingClosingMM is a molecular modeling tool for identifying ring-closing conformations. It uses OpenMM engine and SciPy optimizers combined with a special force field that favors ring-closing bond formation.

About

Summary

Ring closing molecular modeling using an OpenMM engine

Information Last Updated

Dec 16, 2025 at 10:35

License

AGPL-3.0

Total Downloads

2

Platforms

noarch Version: 1.0.1