The conformational behavior of a model cyclic pentapeptide-cyclo ( Gly-L-Pro-D-Phe-Gly-L-Val) -has been explored through the combined use of in vacuo molecular dynamics simulations and a range of nmr experiments (preceding paper). The molecular dynamics analysis suggests that, despite the conformati
✦ LIBER ✦
Correction to “Experimental Verification of Force Fields for Molecular Dynamics Simulations Using Gly-Pro-Gly-Gly”
✍ Scribed by Aliev, Abil E.; Courtier-Murias, Denis
- Book ID
- 127311736
- Publisher
- American Chemical Society
- Year
- 2012
- Tongue
- English
- Weight
- 110 KB
- Volume
- 116
- Category
- Article
- ISSN
- 0022-3654
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## Abstract **Symbiosis:** Far‐infrared spectra can be used to check the quality of force fields for molecular dynamics simulations of ionic liquids. On the other hand, MD simulations can explain the molecular basis of measured properties for this new liquid material (see picture).magnified image