Conxunto de datos - ATB Repository

1x pediocin PA-1 in water at pH 7 and 298 K 3/3

Pediocin PA-1 antimicrobial peptide in SPC water, 100 mM NaCl, 298 K, neutral pH, simulated for 700 ns
- mdp
- itp
- xtc
- log
- edr
- top
- tpr
- gro
1x pediocin PA-1 with a POPC lipid bilayer at pH 5 1/3

Pediocin PA-1 antimicrobial peptide with 512-POPC lipid bilayer in water, 100 mM NaCl, low-pH protonation state (LYSH and HISH), simulated for 400 ns, initial 150 ns contained...
- mdp
- itp
- md1.xtc
- log
- edr
- ndx
- top
- tpr
- gro

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