MDAPackmol | MDAnalysis wrapper around Packmol

by MDAnalysis Python Version: Current License: Non-SPDX

X-Ray Key Features Code Snippets Community Discussions Vulnerabilities Install Support

kandi X-RAY | MDAPackmol Summary

MDAPackmol is a Python library. MDAPackmol has no bugs, it has no vulnerabilities, it has build file available and it has low support. However MDAPackmol has a Non-SPDX License. You can download it from GitHub.

MDAnalysis wrapper around Packmol

Support

Quality

Security

License

Reuse

Support

MDAPackmol has a low active ecosystem.

It has 23 star(s) with 6 fork(s). There are 9 watchers for this library.

It had no major release in the last 6 months.

MDAPackmol has no issues reported. There are no pull requests.

It has a neutral sentiment in the developer community.

The latest version of MDAPackmol is current.

Quality

MDAPackmol has 0 bugs and 0 code smells.

Security

MDAPackmol has no vulnerabilities reported, and its dependent libraries have no vulnerabilities reported.

MDAPackmol code analysis shows 0 unresolved vulnerabilities.

There are 0 security hotspots that need review.

License

MDAPackmol has a Non-SPDX License.

Non-SPDX licenses can be open source with a non SPDX compliant license, or non open source licenses, and you need to review them closely before use.

Reuse

MDAPackmol releases are not available. You will need to build from source code and install.

Build file is available. You can build the component from source.

It has 301 lines of code, 19 functions and 6 files.

It has medium code complexity. Code complexity directly impacts maintainability of the code.

Top functions reviewed by kandi - BETA

kandi has reviewed MDAPackmol and discovered the below as its top functions. This is intended to give you an instant insight into MDAPackmol implemented functionality, and help decide if they suit your requirements.

Reassign a topology to a new structure .
Calculates the density for a target density .
Create packmol input .
Run packmol .
Return packed packmol instruction .
Saves a single molecule .
Run Packmol .
Remove temporary temporary files
Load Packmol output .

Get all kandi verified functions for this library.

MDAPackmol Key Features

No Key Features are available at this moment for MDAPackmol.

MDAPackmol Examples and Code Snippets

No Code Snippets are available at this moment for MDAPackmol.

Community Discussions

No Community Discussions are available at this moment for MDAPackmol.Refer to stack overflow page for discussions.

Community Discussions, Code Snippets contain sources that include Stack Exchange Network

Vulnerabilities

No vulnerabilities reported

Install MDAPackmol

You can download it from GitHub.
You can use MDAPackmol like any standard Python library. You will need to make sure that you have a development environment consisting of a Python distribution including header files, a compiler, pip, and git installed. Make sure that your pip, setuptools, and wheel are up to date. When using pip it is generally recommended to install packages in a virtual environment to avoid changes to the system.

Support

For any new features, suggestions and bugs create an issue on GitHub. If you have any questions check and ask questions on community page Stack Overflow .

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