Skip to content

Releases: pegerto/graphpro

0.24.0

25 Mar 21:01

Choose a tag to compare

add mimmax for energy normalization

0.23.2

20 Mar 22:40

Choose a tag to compare

error with partitioned graphs

0.23.1

11 Mar 15:23

Choose a tag to compare

allow configure cutoff bt eigen values

0.23.0

11 Mar 14:30
0040b8a

Choose a tag to compare

eigen_bt_calculation (#42)

Co-authored-by: Pegerto Fernandez <pegerto.fernandez@creditkarma.com>

0.22.0

05 Mar 08:56
fe13e28

Choose a tag to compare

Graph Edge to direct graph only.

0.21.1

15 Feb 20:02

Choose a tag to compare

rename BT potential class

0.21.0

15 Feb 19:53
76c70cf

Choose a tag to compare

BT Potential (#40)

0.20.1

23 Jan 15:10

Choose a tag to compare

dssp: fix partial residues with incompleated atoms

0.20.0

07 Dec 22:51
14bd21b

Choose a tag to compare

add conservation score annotation (#39)

Co-authored-by: Pegerto Fernandez <pegerto.fernandez@creditkarma.com>

0.19.0

14 Nov 09:36

Choose a tag to compare

add KNN as method