 David Sehnal
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e987d73d2b
BinaryCIF support
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7 years ago |
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David Sehnal
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8b1552d344
Added stringEquals to column
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7 years ago |
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David Sehnal
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25559611c6
Fixed cif test
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7 years ago |
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David Sehnal
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6979ae8254
mmCIF schema
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7 years ago |
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David Sehnal
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c5b1b84eb2
Data model improvements
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7 years ago |
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David Sehnal
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c236b5d015
Started CIF parser
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7 years ago |
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David Sehnal
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18891f5bae
Pooled string column
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7 years ago |
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David Sehnal
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135635ac06
Changed data model, updated GRO parser to handle velocities, arbitrary precision, multiple models
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7 years ago |
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David Sehnal
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7431964b63
one more trim fix
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7 years ago |
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David Sehnal
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063be5b225
trim fix
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7 years ago |
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David Sehnal
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3352740a92
Naming things
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7 years ago |
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David Sehnal
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87dbbe3323
Updated to new data model
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7 years ago |
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David Sehnal
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b30ebceeef
Naming things
|
7 years ago |
|
David Sehnal
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ac40a2b874
Data model
|
7 years ago |
|
David Sehnal
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c3a5760de1
Tweak
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7 years ago |
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David Sehnal
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9cf93363eb
Data model for tables and schema
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7 years ago |
|
Alexander Rose
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b12f11af03
renamed table to category, added File and Block classes, typed category and column objects
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7 years ago |
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Alexander Rose
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5e91cff080
fixed license
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7 years ago |
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Alexander Rose
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3966737075
updated readme with todo
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7 years ago |
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Alexander Rose
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33cf1473b1
updated readme
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7 years ago |
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Alexander Rose
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75366fab06
gro, added example files
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7 years ago |
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Alexander Rose
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609aa648b2
added dist files
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7 years ago |
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Alexander Rose
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a14579b627
gro, high precision example
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7 years ago |
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Alexander Rose
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6fd5e1908b
gro, faster atom line handling
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7 years ago |
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Alexander Rose
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07c3377ddb
started with gro reader
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7 years ago |
