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FEASST: Free Energy and Advanced Sampling Simulation Toolkit

Metadata Updated: July 29, 2022

The Free Energy and Advanced Sampling Simulation Toolkit (FEASST) is a free, open-source, modular program to conduct molecular and particle-based simulations with flat-histogram Monte Carlo and molecular dynamics methods. It is a software written in C++ and python which is made publicly available to aid in reproducibility. It is also provided as a service to the scientific community in which there are few , if any, Monte Carlo programs that support flat histogram methods and advanced sampling algorithms. This software is expected to be updated frequently with new methods.

Access & Use Information

Public: This dataset is intended for public access and use. License: See this page for license information.

Downloads & Resources

Dates

Metadata Created Date March 11, 2021
Metadata Updated Date July 29, 2022
Data Update Frequency irregular

Metadata Source

Harvested from NIST

Additional Metadata

Resource Type Dataset
Metadata Created Date March 11, 2021
Metadata Updated Date July 29, 2022
Publisher National Institute of Standards and Technology
Maintainer
Identifier 5D00D811BC74B453E0531A570681BC861875
Language en
Data Last Modified 2017-11-02
Category Physics: Thermodynamics, Mathematics and Statistics: Numerical methods and software, Materials : Modeling and computational material science, Chemistry: Theoretical chemistry and modeling, Chemistry: Chemical thermodynamics and chemical properties, Manufacturing: Biomanufacturing, Mathematics and Statistics: Modeling and simulation research, Nanotechnology: Nanomaterials, Physics: Biological physics
Public Access Level public
Data Update Frequency irregular
Bureau Code 006:55
Metadata Context https://project-open-data.cio.gov/v1.1/schema/data.json
Schema Version https://project-open-data.cio.gov/v1.1/schema
Catalog Describedby https://project-open-data.cio.gov/v1.1/schema/catalog.json
Harvest Object Id 3a523010-e8eb-42aa-b332-9d2a4c690dcc
Harvest Source Id 74e175d9-66b3-4323-ac98-e2a90eeb93c0
Harvest Source Title NIST
Homepage URL https://pages.nist.gov/feasst
License https://www.nist.gov/open/license
Program Code 006:045
Source Datajson Identifier True
Source Hash 9859dd8198368c3a68984893b4ddb8a83f7e3daf
Source Schema Version 1.1

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