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safep
PublicTools for Analyzing and Debugging (SA)FEP calculations. See also the SAFEP Tutorial: https://github.com/jhenin/SAFEP_tutorial/tree/main Documentation: https://safep-alchemy.readthedocs.io/en/latest/- Scripts to Assist Density Threshold Affinity Analysis - a method for obtaining free energies of protein-lipid binding. Originally described in: https://pubs.aip.org/aip/jcp/article/154/18/185102/200265/Spontaneous-lipid-binding-to-the-nicotinic and subsequently refined in: https://doi.org/10.1016/bs.mie.2024.03.008
blobulator
PublicCommunications
Public- Data and Analyses related to "Structural mechanism of leaflet-specific phospholipid modulation of a pentameric ligand-gated ion channel". Results in preprint (bioRxiv) 2022. doi: https://doi.org/10.1101/2022.06.07.494883
nougat
PublicBranniganLab.github.io
Publicdensitymap
PublicThis project has moved to: https://github.com/BranniganLab/density_threshold_affinity. VMD and python tools for calculating and plotting 2D lipid density maps.lipid-monte-carlo
Public