Print Email Facebook Twitter Highlights of (bio-)chemical tools and visualization software for computational science Title Highlights of (bio-)chemical tools and visualization software for computational science Author Dubbeldam, David (Universiteit van Amsterdam) Vreede, Jocelyne (Universiteit van Amsterdam) Vlugt, T.J.H. (TU Delft Engineering Thermodynamics) Calero, Sofia (University Pablo de Olavide) Date 2019 Abstract Computational chemistry uses computer simulation to assist in solving chemical problems. Typical workflows of computational chemists include the use of dozens of utilities. 3D modeling programs are powerful tools that help researchers visualize their work and create illustrative graphics. In this review, we describe and highlight tools and visualization packages that are commonly used in the field of (bio-)chemistry and material science. To reference this document use: http://resolver.tudelft.nl/uuid:aa3833ac-665a-4c06-a3fa-9f8626db55cc DOI https://doi.org/10.1016/j.coche.2019.02.001 Embargo date 2021-03-01 ISSN 2211-3398 Source Current Opinion in Chemical Engineering, 23, 1-13 Bibliographical note Accepted Author Manuscript Part of collection Institutional Repository Document type review Rights © 2019 David Dubbeldam, Jocelyne Vreede, T.J.H. Vlugt, Sofia Calero Files PDF paper.pdf 3.33 MB Close viewer /islandora/object/uuid:aa3833ac-665a-4c06-a3fa-9f8626db55cc/datastream/OBJ/view