Releases: pegerto/graphpro
Releases · pegerto/graphpro
0.24.0
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add mimmax for energy normalization
0.23.2
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error with partitioned graphs
0.23.1
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allow configure cutoff bt eigen values
0.23.0
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eigen_bt_calculation (#42)
Co-authored-by: Pegerto Fernandez <pegerto.fernandez@creditkarma.com>
0.22.0
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Graph Edge to direct graph only.
0.21.1
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rename BT potential class
0.21.0
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BT Potential (#40)
0.20.1
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dssp: fix partial residues with incompleated atoms
0.20.0
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add conservation score annotation (#39)
Co-authored-by: Pegerto Fernandez <pegerto.fernandez@creditkarma.com>
0.19.0
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add KNN as method