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Details of SAPdb ID 1254

Primary information
SAPdb_ID	1254
PMID	22468743
Year	2012
Name	DiPhenylalanine
Sequence	FF
N-Terminal Modification	Free
C-Terminal Modification	Free
Non-terminal Modication	None
Length	2
Peptide/Conjugate/Mixture	Peptide
Conjugate Partner	None
Technique	Insilico tools i.e, Coarse - grained molecular dynamics (MD) simulations and GROMACS software
Solvent	Water
Method	40 MD simulations performed on a system consisting of 600 FF peptides at peptide concentrations: 85mg/mL
Concentration	85 mg/ml
pH	NA
Temperature	37 °C
Incubation Period	60 - 1200 nanoseconds
Self-Assembly Formation	Yes
Type of Self-Assembly	Spherical vesicle ( in 7/10 MD runs); Nanotube (in 2/10 MD runs); Bialyer shape (in 1/10 MD runs)
Size of Self-Assembled structure	Diameter of vesicle : 9.2 nm; Diameter of nanotube : ∼5.1 to ∼5.6 nm
Linear/Cyclic	Linear
Stability of Nanostructure	Stable
Comment	NA
Secondary information
Physico-Chemical properties	Physico-Chemical properties
STRUCTURE	Predicted Structure
SMILES	N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C=O