O'Mara lab

Multi-scale modelling of biological systems

GlyT2_mutants Public

0 0 0 0 Updated Sep 1, 2022
PsaBC_dynamics Public
Investigating the dynamics of the PsaBC ABC importer

0 MIT 1 0 0 Updated May 2, 2022
PsaA_metal_ion_FF_comparison Public
Supplementary data for paper on PsaA force-field comparison.

Jupyter Notebook 0 MIT 1 0 0 Updated May 1, 2022
ACT-Chlor-MeOH Public
Collaboration with Connal group on ACT in non-polar solvent

0 0 0 0 Updated Mar 28, 2022
psiresp Public
RESP with inter- and intra-molecular constraints in Psi4.

Python 0 LGPL-3.0 6 0 0 Updated Mar 27, 2022
epithelial_membrane Public
Supplementary data files for "A Computational Model Replicating the Lipid Composition of a Human Epithelial Plasma Membrane "

0 MIT 1 0 0 Updated Mar 24, 2022
TmEnc_Flux Public
MD trajectories and analysis scripts for a forthcoming paper.

Python 0 2 0 0 Updated Mar 24, 2022
Abaumanii_MARTINI_membrane Public

Python 0 MIT 1 0 0 Updated Mar 24, 2022
Neuronal_PM_complexity_MARTINI Public

0 MIT 1 0 0 Updated Mar 24, 2022
Neuronal_Oxidized_CHOL Public

0 MIT 0 0 0 Updated Mar 2, 2022

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