dlmontepython

Python library containing tools for automation, histogram reweighting and data analysis, among other things. See README.md for further details, including links to documentation.

https://gitlab.com/dl_monte/dlmontepython

Science Score: 28.0%

This score indicates how likely this project is to be science-related based on various indicators:

  • CITATION.cff file
    Found CITATION.cff file
  • codemeta.json file
  • .zenodo.json file
  • DOI references
  • Academic publication links
  • Committers with academic emails
    3 of 6 committers (50.0%) from academic institutions
  • Institutional organization owner
  • JOSS paper metadata
  • Scientific vocabulary similarity
    Low similarity (5.6%) to scientific vocabulary
Last synced: 11 months ago · JSON representation ·

Repository

Python library containing tools for automation, histogram reweighting and data analysis, among other things. See README.md for further details, including links to documentation.

Basic Info
  • Host: gitlab.com
  • Owner: dl_monte
  • License: bsd-3-clause
  • Default Branch: master
Statistics
  • Stars: 2
  • Forks: 2
  • Open Issues: 4
  • Releases: 0
Created about 7 years ago
Metadata Files
Readme License Citation

README

Python tools associated with the Monte Carlo simulation program DL_MONTE
(project homepage: https://gitlab.com/dl_monte).

Key functionality includes:
- Functions for applying various analysis methods to data obtained from
  molecular simulation, including histogram reweighting and block averaging
- A Python interface to DL_MONTE
- A framework for automating calculations of, e.g. isotherms, using DL_MONTE 

See the 'README.md' file for more detailed information about this library.

Citation (CITATION)

Please cite the following articles in publications which make use of dlmontepython:

- "DL_MONTE: a multipurpose code for Monte Carlo simulation", A. V. Brukhno, J. Grant, T. L. Underwood, K. Stratford, S. C. Parker, J. A. Purton & N. B. Wilding, Molecular Simulation, DOI: 10.1080/08927022.2019.1569760 (2019)


Committers

Last synced: over 3 years ago

All Time
  • Total Commits: 126
  • Total Committers: 6
  • Avg Commits per committer: 21.0
  • Development Distribution Score (DDS): 0.381
Top Committers
Name Email Commits
Tom Underwood t****d@b****k 78
John Purton j****1@g****m 19
jrhmanning j****1@b****k 17
Joe Manning j****g@m****k 10
Joe Manning j****1@b****a 1
Joe Manning j****1@b****a 1
Committer Domains (Top 20 + Academic)

Issues and Pull Requests

Last synced: about 2 years ago

Packages

  • Total packages: 1
  • Total downloads:
    • pypi 13 last-month
  • Total dependent packages: 0
  • Total dependent repositories: 1
  • Total versions: 10
  • Total maintainers: 1
pypi.org: dlmontepython

Tools associated with the Monte Carlo simulation program DL_MONTE

  • Versions: 10
  • Dependent Packages: 0
  • Dependent Repositories: 1
  • Downloads: 13 Last month
Rankings
Dependent packages count: 10.1%
Forks count: 19.2%
Dependent repos count: 21.6%
Average: 23.4%
Stargazers count: 27.9%
Downloads: 38.2%
Maintainers (1)
Last synced: 11 months ago