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Refinement of the application of the GROMOS 54A7 force field to β‐peptides |
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| Authors: | Zhixiong Lin Wilfred F van Gunsteren |
| Institution: | Laboratory of Physical Chemistry, Swiss Federal Institute of Technology, , ETH, 8093 Zürich, Switzerland |
| Abstract: | |
| Keywords: | molecular dynamics • force field • GROMOS • 54A7 • 54A7_β • one‐step perturbation |