coord.data.frame.R | Atom coordinates to data frame |
dihe.trj | Dihedral angles from Molecular Dynamics in Matrix |
dist.trj | Atom distances from Molecular Dynamics Trajectories |
filled.contour.lines | Color Filled Contour Plot with multiple options |
free.energy | Free Energy from Molecular Dynamics Distributions |
ma | Simple moving average procedure |
qfilled.contour | Quick Color Filled Contour Plot |
red2blue.rmcpalettes | Palettes of RMD package |
rmdfilled.contour | Custom version of filled.contour |
rmdsmooth.spline | Quick smoothing with spline |
surf.spline.smooth | Quick surface smoothing with thin plate spline |
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