 David Sehnal
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36ee1089a8
updated packages
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4 years ago |
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David Sehnal
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723bf3e657
model-server: 404 response on missing inputs
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4 years ago |
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David Sehnal
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dc08e524b3
1.1.6
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4 years ago |
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David Sehnal
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3ecd305adf
Merge pull request #73 from JonStargaryen/chem-comp
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4 years ago |
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JonStargaryen
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60eb42391e
use isNonMetalBond
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4 years ago |
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JonStargaryen
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26f5210518
make ctx-aware
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4 years ago |
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JonStargaryen
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7b41d800c0
use for of to check non-metals
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4 years ago |
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JonStargaryen
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3aa9ef7595
rename chem_comp_bond to chem_comp_dict
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4 years ago |
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JonStargaryen
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fad5a40ec4
Merge remote-tracking branch 'upstream/master' into chem-comp
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4 years ago |
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JonStargaryen
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58e0ba016e
rename to atoms/chem_comp and bonds/chem_comp
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4 years ago |
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JonStargaryen
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b8f168ebf5
iterators
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4 years ago |
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JonStargaryen
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560c26c73f
wip mol2
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4 years ago |
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JonStargaryen
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73ada6b1f1
rewire mol/sdf
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4 years ago |
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JonStargaryen
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4f2cee3b56
introduce map, ditch getLabel
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4 years ago |
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David Sehnal
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ad6975c99d
1.1.5
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4 years ago |
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David Sehnal
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bea462b8b2
Fix servers build error
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4 years ago |
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David Sehnal
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5652fa55db
updated packages
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4 years ago |
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David Sehnal
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d2208a0814
mol-plugin: createPluginAsync, initial Canvas3DProps in PluginSpec
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4 years ago |
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David Sehnal
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62a456ce82
mol-plugin-state: support ArrayBuffer/Uint8Array raw binary data
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4 years ago |
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David Sehnal
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bef1142a31
1.1.4
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4 years ago |
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David Sehnal
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8e07de62dc
fix auth_comp_id property access
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4 years ago |
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JonStargaryen
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347b9ead6b
add atomTablePath to default config
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4 years ago |
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JonStargaryen
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6d9a09620c
propagate chem_comp_atom data
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4 years ago |
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JonStargaryen
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17349b8529
sybyl atom types
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4 years ago |
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Alexander Rose
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3a200fe2d7
add label_seq_id when undefined- serial no, 1-based for each chain, see #72
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4 years ago |
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Alexander Rose
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10bd513680
refactored pdb format label_seq_id handling
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4 years ago |
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Alexander Rose
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9214c54e7d
add CifField.ofUndefined
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4 years ago |
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Alexander Rose
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64da492d63
fix non-standard residue check when filed not given
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4 years ago |
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JonStargaryen
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cbb65aaaac
fix missing data in bond table
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4 years ago |
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JonStargaryen
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78c9dda257
wip sybyl
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4 years ago |
