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Official Release PyMOL v2.4 has been released on May 20, 2020.
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New Plugin PICv is a new plugin for clustering protein-protein interactions and visualization with available data from PDBe
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New Script dssr_block is a wrapper for DSSR (3dna) and creates block-shaped nucleic acid cartoons
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Type PyMOL Plugin
Download plugins/optimize.py
Author(s) Osvaldo Martin
License MIT
This code has been put under version control in the project Pymol-script-repo

Introduction

Optimize provides a PyMOL graphical interface to some of the molecular mechanics features available in openbabel, allowing the user to optimize (minimize) the energy of any molecule uploaded on PyMOL.

Installation

The plugin can be downloaded through the project Pymol-script-repo.

Optimize needs OpenBabel (and OpenBabel Python bindings) to be installed on your computer (see instructions here).

Note to Windows users: If you are using a 64-bit Windows, please install OpenBabel 64-bit from here

Usage

The plugin can be accessed using a graphic user interface (see figure 0) or from the PyMOL`s terminal. There are 5 types of optimization routines available now, 2 local and 3 global optimization routines.

== Local ..→

A Random PyMOL-generated Cover. See Covers.