Going Backward: A Flexible Geometric Approach to Reverse Transformation from Coarse Grained to Atomistic Models.
By Tsjerk A. Wassenaar, Kristyna Pluhackova, R. Böckmann, Siewert-Jan Marrink, D. Peter Tieleman. Journal of Chemical Theory and Computation, 2014
662 citations recorded by the source corpus.
Subfields: Astronomy and Astrophysics, Mechanical Engineering, Molecular Biology
View Paper: https://www.semanticscholar.org/paper/2b02110b12a487ef9a4fa0ef2cfcdb1a62b36187
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In Molecular Biology
- Helgi I. Ingólfsson
- Siewert-Jan Marrink
- D. Peter Tieleman
- Valentina Corradi
- Svetlana Baoukina
- Djurre H. De Jong
Citations in the corpus
- Computational Modeling of Realistic Cell Membranes (2019, methodology): “165,166 This is a potentially powerful approach, but there is no guarantee at the moment that Martini and atomistic FFs (or indeed di ff erent atomistic FFs) give the same equilibrium distribution of lipids in a mixture, insane is speci fi c to GROMACS, 167 and backmapping of very complex systems…”