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1x pediocin PA-1 with a POPC lipid bilayer at pH 5 2/3
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... -
1x pediocin PA-1 with a O3MPC lipid bilayer at pH 5 2/3
Pediocin PA-1 antimicrobial peptide with 512-O3MPC lipid bilayer in water, 100 mM NaCl, low-pH protonation state (LYSH and HISH), simulated for 300 ns -
56x Triclosan molecules with a POPC lipid bilayer 2/3
56 molecules of triclosan (28 (M)-triclosan and 28 (P)-triclosan) in water with a POPC lipid bilayer, 100 nM NaCl, simulated for 450 ns, initial 120 ns contained boundary wall... -
56x Triclosan molecules with a PDPC lipid bilayer 2/3
56 molecules of triclosan (28 (M)-triclosan and 28 (P)-triclosan) in water with a PDPC lipid bilayer, 100 nM NaCl, simulated for 450 ns, initial 150 ns contained boundary wall... -
56x Triclosan molecules with a DIPC lipid bilayer 2/3
56 molecules of triclosan (28 (M)-triclosan and 28 (P)-triclosan) in water with a DIPC lipid bilayer, 100 nM NaCl, simulated for 450 ns, initial 150 ns contained boundary wall... -
56x Chloroxylenol molecules with a PCMSC lipid bilayer 2/3
56x Chloroxylenol (PCMX) molecules in water with a PCMSC lipid bilayer, 100 nM NaCl, simulated for 400 ns, initial 150 ns contained boundary wall to prevent periodic... -
56x Chloroxylenol molecules with a POPC lipid bilayer 2/3
56x Chloroxylenol (PCMX) molecules in water with a POPC lipid bilayer, 100 nM NaCl, simulated for 350 ns, initial 120 ns contained boundary wall to prevent periodic interaction.... -
56x Chloroxylenol molecules with a DIPC lipid bilayer 2/3
56x Chloroxylenol (PCMX) molecules in water with a DIPC lipid bilayer, 100 nM NaCl, simulated for 400 ns, initial 150 ns contained boundary wall to prevent periodic interaction.... -
1x P-Triclosan molecule with a DIPC lipid bilayer 2/3
1x P-Triclosan (P-TCS) in water with a POPC lipid bilayer, 100 nM NaCl, simulated for 200 ns -
1x P-Triclosan molecule with a PCMSC lipid bilayer 2/3
1x P-Triclosan (P-TCS) in water with a PCMSC lipid bilayer (PCMSC is equivalent to POPC wherein the double bound in Ole is methylenated), 100 nM NaCl, simulated for 200 ns -
1x P-Triclosan molecule with a DIPC lipid bilayer 2/3
1x P-Triclosan (P-TCS) in water with a DIPC lipid bilayer, 100 nM NaCl, simulated for 200 ns -
1x M-Triclosan molecule with a DIPC lipid bilayer 2/3
1x M-Triclosan (M-TCS) in water with a POPC lipid bilayer, 100 nM NaCl, simulated for 200 ns -
1x M-Triclosan molecule with a PCMSC lipid bilayer 2/3
1x M-Triclosan (M-TCS) in water with a PCMSC lipid bilayer (PCMSC is equivalent to POPC wherein the double bound in Ole is methylenated), 100 nM NaCl, simulated for 200 ns -
1x M-Triclosan molecule with a DIPC lipid bilayer 2/3
1x M-Triclosan (M-TCS) in water with a DIPC lipid bilayer, 100 nM NaCl, simulated for 200 ns -
512-DPPC lipid bilayer 2/3
Hydrated 512-DPPC lipid bilayer simulated for 5500 ns -
DPPC lipid bilayer 2/3
Hydrated 288-DPPC lipid bilayer simulated for 400 ns -
PPPC lipid bilayer 2/3
Hydrated lipid bilayer of 288 1-((2S,4S,6S,8S,10S)-2,4,6,8,10-pentamethylpalmitoyl)-2-palmitoyl-sn-glycero-3-phosphocholine (PPPC) simulated for 350 ns -
NPPC lipid bilayer 2/3
Hydrated lipid bilayer of 288 1-neostearoyl-2-palmitoylPC simulated for 350 ns -
M8PPC lipid bilayer 2/3
Hydrated lipid bilayer of 288 1-(S-8-methylpalmitoyl)-2-palmitoylPC simulated for 350 ns -
M6PPC lipid bilayer 2/3
Hydrated lipid bilayer of 288 1-(S-6-methylpalmitoyl)-2-palmitoylPC simulated for 350 ns
