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_spec
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fb0634a0f4
added semicolons to linting rules
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5 anni fa |
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basic
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c29648ac9b
more reusable units, added model.parent, finer repr updates
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4 anni fa |
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common
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94cd5d3395
support for recommended iso value volumes
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4 anni fa |
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pdb
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10bd513680
refactored pdb format label_seq_id handling
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4 anni fa |
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property
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cb1f52a8f4
index-pairs bonds fixes & improvements, better cif-core bond handling
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4 anni fa |
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3dg.ts
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482059cc9b
first class Trajectory object
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4 anni fa |
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cif-core.ts
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cb1f52a8f4
index-pairs bonds fixes & improvements, better cif-core bond handling
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4 anni fa |
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cube.ts
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482059cc9b
first class Trajectory object
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4 anni fa |
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dcd.ts
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fb0634a0f4
added semicolons to linting rules
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5 anni fa |
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gro.ts
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482059cc9b
first class Trajectory object
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4 anni fa |
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mmcif.ts
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482059cc9b
first class Trajectory object
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4 anni fa |
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mol.ts
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482059cc9b
first class Trajectory object
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4 anni fa |
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mol2.ts
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482059cc9b
first class Trajectory object
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4 anni fa |
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pdb.ts
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482059cc9b
first class Trajectory object
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4 anni fa |
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psf.ts
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aca49b9ba5
PSF parser fix, correct topology/coordinates ordering (wip)
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5 anni fa |
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util.ts
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a5c039bf11
fix Si-Si bonds
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5 anni fa |
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xtc.ts
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11d5e301f3
xtc format support
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5 anni fa |
Alexander Rose
c29648ac9b
more reusable units, added model.parent, finer repr updates