 Alexander Rose
|
f65f4f4aeb
seperate grid and boundary calculation
|
5 éve |
|
Alexander Rose
|
4c91e730a2
various params tweaks
|
5 éve |
|
Alexander Rose
|
adbe8e1f67
take parent structure into account for surface calculations
|
5 éve |
|
Alexander Rose
|
032d2f2784
removed fillUniform, use Array.fill
|
5 éve |
|
Alexander Rose
|
27963b5aed
added option to ignore hydrogens in structure representations
|
5 éve |
|
Alexander Rose
|
08e92f12d3
improved MolecularSurface calc: projectToriiRange
|
5 éve |
|
Alexander Rose
|
2c55165c84
use relative paths for module imports
|
6 éve |
|
Alexander Rose
|
c05b67bdd7
allow more coarse resolution
|
6 éve |
|
Alexander Rose
|
cbf86ecec4
molecular surface improvements
|
6 éve |
|
Alexander Rose
|
735e497a1d
wip, molsurf
|
6 éve |
|
Alexander Rose
|
a7ceb307e9
grid size calc fixes
|
6 éve |
|
Alexander Rose
|
a3e95fdf78
wip, gaussian surface
|
6 éve |
|
Alexander Rose
|
ec379968cd
wip, molsurf
|
6 éve |
|
Alexander Rose
|
2d164232ac
wip, molsurf
|
6 éve |
|
Alexander Rose
|
ab6a093561
wip, mol surf
|
6 éve |
