 JonStargaryen
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220e01106f
lint
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5 лет назад |
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JonStargaryen
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240de5b24d
cleanup
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5 лет назад |
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JonStargaryen
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17a001427b
spelling
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5 лет назад |
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JonStargaryen
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a423970b9c
basic ligand writing
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5 лет назад |
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JonStargaryen
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56f4c8775f
cleanup
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5 лет назад |
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JonStargaryen
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5ed4aa0fae
SdfFile tweaks
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5 лет назад |
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JonStargaryen
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4f4245b895
sdf def, reader, spec
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5 лет назад |
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JonStargaryen
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bc6d2112e2
refactoring
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5 лет назад |
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JonStargaryen
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3b2b87d264
tweaks to sdf output
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5 лет назад |
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JonStargaryen
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7cfdc8ab1b
lint
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5 лет назад |
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JonStargaryen
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52e011ade9
wip query mode
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5 лет назад |
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JonStargaryen
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895e2ede2d
mol2 stub
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5 лет назад |
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JonStargaryen
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3a25769a94
style
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5 лет назад |
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JonStargaryen
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5db4b48a86
putative check for compatible encoding
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5 лет назад |
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JonStargaryen
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40bbd87c4e
unique group check
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5 лет назад |
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JonStargaryen
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fb7dd66600
cleanup
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5 лет назад |
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JonStargaryen
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e12dc2b089
tweak mapping
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5 лет назад |
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JonStargaryen
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78242b18c3
hydrogen handling
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5 лет назад |
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JonStargaryen
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9043e4c8e1
propagate atoms only if present
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5 лет назад |
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JonStargaryen
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54b5e3a0cc
hydrogen option
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5 лет назад |
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JonStargaryen
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b6719a2f57
always write error category
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5 лет назад |
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JonStargaryen
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087d5fbb68
stub for sdf writing
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5 лет назад |
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JonStargaryen
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8e350617f2
wip sdf
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5 лет назад |
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Alexander Rose
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feb167dcf8
fix case of DDmanHep and LDmanHep
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5 лет назад |
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Alexander Rose
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1b53ea846b
added 6 more common saccharide names
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5 лет назад |
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Alexander Rose
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88b9be5fd1
Merge branch 'master' of https://github.com/molstar/molstar
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5 лет назад |
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Alexander Rose
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89486ea9e2
clip objects & per group clipping
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5 лет назад |
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Alexander Rose
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86c09ead98
added Model helpers
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5 лет назад |
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Alexander Rose
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1f60d887a8
add gap even for consecutive residues if they are not connected
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5 лет назад |
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Alexander Rose
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a672115505
Merge branch 'master' of https://github.com/molstar/molstar
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5 лет назад |
