Simulation POPC_512_WALP23_10_5up_5down_NaCl_150mM_310K membrane

Title publication: A Ceramide-Regulated Element in the Late Endosomal Protein LAPTM4B Controls Amino Acid Transporter Interaction Year publication: 2018 DOI publication: 10.1021/acscentsci.7b00582 Description: Simulation POPC membrane containing ten WALP23 peptides ausing charmm36 at 310K. MD engine: gromacs 5.0.4 Force field: charmm36 Temperature: 310 K Pressure: 1 bar Simulation time: 2000 ns Saving frequency: 100 ps Molecular content: WALP23 10 POPC 512 SOL 20480 NA 55 CL 55 Additional information: * Membrane containing WALP23 peptides (Ac-GWWLALALALALALALALALWWA-NH2).

Related Organizations

Czech Academy of Sciences
Czech Republic
Institute of Organic Chemistry and Biochemistry
Czech Republic

Keywords

Charmm36, membrane, simulation, gromacs, POPC, WALP23, peptide, transmembrane, Charmm36, membrane, simulation, gromacs, POPC, WALP23, peptide, transmembrane

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