Pinned Loading
- PPIS-MDPharma
PPIS-MDPharma PublicObtain protein-protein interaction stabilizers from molecular dynamics simulation derived pharmacophores
Python 3
- Add-NME-ACE-residues-to-protein-terminal-residues
Add-NME-ACE-residues-to-protein-terminal-residues PublicAdd NME and ACE chemical groups to protein terminal residues
- undulation-corrected-density-for-lipid-bilayers
undulation-corrected-density-for-lipid-bilayers PublicThe scripts here calculates transverse electron/mass density or neutron SLD for all-atom or Martini membrane systems. The code performs Undulation correction of larger membranes
Python 1
- Generate-silica-itp-file-Gromacs
Generate-silica-itp-file-Gromacs PublicThe scripts in this repository creates Gromacs itp files for all-atom simulation of Silica in combination with AMBER force field. For Charmm slight change is required. Refer to the reference in des…
Python 2
- ProteinBinder-MDPharma
ProteinBinder-MDPharma PublicObtain protein binders from MD generated pharmacophore
Python
- bio-phys/ForceFieldsMC3
bio-phys/ForceFieldsMC3 Public
Something went wrong, please refresh the page to try again.
If the problem persists, check the GitHub status page or contact support.
If the problem persists, check the GitHub status page or contact support.
Uh oh!
There was an error while loading. Please reload this page.