GEMS-Pack: A Graphical User Interface for the Packmol Program
Author:
Affiliation:
1. Molecular Modeling Laboratory, Center of Mineral Technology (CETEM), Av. Pedro Calmon, 900, Ilha da Cidade Universitaria, 21941-908 Rio de Janeiro, RJ, Brazil
Funder
Conselho Nacional de Desenvolvimento Cient?fico e Tecnol?gico
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.9b00740
Reference13 articles.
1. Molecular Modeling of Matter: Impact and Prospects in Engineering
2. From discovery to data: What must happen for molecular simulation to become a mainstream chemical engineering tool
3. GROMACS: A message-passing parallel molecular dynamics implementation
4. OpenMM 7: Rapid development of high performance algorithms for molecular dynamics
5. Fast Parallel Algorithms for Short-Range Molecular Dynamics
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