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pdbe
ccdutils
Commits
210a08e1
Commit
210a08e1
authored
Jan 12, 2019
by
Lukas Pravda
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release
parent
7f458f00
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CHANGELOG.md
CHANGELOG.md
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pdbeccdutils/__init__.py
pdbeccdutils/__init__.py
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CHANGELOG.md
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210a08e1
# Changelog
## RELEASE 0.4 - January 12, 2019
### Features
*
Add SVG decomposition in the SVG format.
*
Protein-ligand interaction pipeline moved to separate
[
repository
](
https://gitlab.ebi.ac.uk/pdbe/release/interactions
)
.
*
Add basic properties calculation (Abhik).
*
Extension and improvements of the Fragment library.
## RELEASE 0.3 - October 12, 2018
### Features
*
Introduce CoordGen from RDKit
*
Refactored pdbeccdutils.core (
**breaking changes**
)
*
Scaffolding (Abhik)
*
Add protein-ligand interaction pipeline
*
Introduce CoordGen from RDKit
.
*
Refactored pdbeccdutils.core (
**breaking changes**
)
.
*
Scaffolding (Abhik)
.
*
Add protein-ligand interaction pipeline
.
## RELEASE 0.2 - June 14, 2018
### Features
*
PDBeChem pipeline
*
Support for PARITY method
*
PDBeChem pipeline
.
*
Support for PARITY method
.
*
Introduce EKTGv2() method for 3D conformer generation.
pdbeccdutils/__init__.py
View file @
210a08e1
__version__
=
'0.
3.5
'
__version__
=
'0.
4
'
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