Towards molecular simulations that are transparent, reproducible, usable by others, and extensible (TRUE)-Reference-Cited by-同舟云学术

Towards molecular simulations that are transparent, reproducible, usable by others, and extensible (TRUE)

Published:2020-04-08 Issue:9-10 Volume:118 Page:e1742938
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Thompson Matthew W.¹²,Gilmer Justin B.¹²,Matsumoto Ray A.¹²,Quach Co D.¹²,Shamaprasad Parashara¹²,Yang Alexander H.¹²,Iacovella Christopher R.¹²,McCabe Clare¹²,Cummings Peter T.¹²

Affiliation:

1. Department of Chemical and Biomolecular Engineering, Vanderbilt University, Nashville, TN, USA

2. Multiscale Modeling and Simulation Center, Vanderbilt University, Nashville, TN, USA

Funder

National Science Foundation

Division of Advanced Cyberinfrastructure

Division of Chemical, Bioengineering, Environmental, and Transport Systems

Office of Basic Energy Sciences

National Institute of Arthritis and Musculoskeletal and Skin Diseases

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

https://www.tandfonline.com/doi/pdf/10.1080/00268976.2020.1742938

Reference129 articles.

1. 1,500 scientists lift the lid on reproducibility

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4. Large-scale screening of hypothetical metal–organic frameworks

5. The Harvard Clean Energy Project: Large-Scale Computational Screening and Design of Organic Photovoltaics on the World Community Grid

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