 Alexander Rose
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032d2f2784
removed fillUniform, use Array.fill
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%!s(int64=5) %!d(string=hai) anos |
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Alexander Rose
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27963b5aed
added option to ignore hydrogens in structure representations
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%!s(int64=5) %!d(string=hai) anos |
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Alexander Rose
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08e92f12d3
improved MolecularSurface calc: projectToriiRange
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%!s(int64=5) %!d(string=hai) anos |
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Alexander Rose
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2c55165c84
use relative paths for module imports
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%!s(int64=6) %!d(string=hai) anos |
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Alexander Rose
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c05b67bdd7
allow more coarse resolution
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%!s(int64=6) %!d(string=hai) anos |
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Alexander Rose
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cbf86ecec4
molecular surface improvements
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%!s(int64=6) %!d(string=hai) anos |
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Alexander Rose
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735e497a1d
wip, molsurf
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%!s(int64=6) %!d(string=hai) anos |
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Alexander Rose
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a7ceb307e9
grid size calc fixes
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%!s(int64=6) %!d(string=hai) anos |
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Alexander Rose
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a3e95fdf78
wip, gaussian surface
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%!s(int64=6) %!d(string=hai) anos |
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Alexander Rose
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ec379968cd
wip, molsurf
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%!s(int64=6) %!d(string=hai) anos |
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Alexander Rose
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2d164232ac
wip, molsurf
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%!s(int64=6) %!d(string=hai) anos |
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Alexander Rose
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ab6a093561
wip, mol surf
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%!s(int64=6) %!d(string=hai) anos |
