What's new in version 4.1.2?
In version 4.1.2 the code has been updated for being compatible with biopython 1.83 and fpocket version dependency has been fixed to 4.1.
- Compatibility with biopython 1.83.
- Fpocket fixed to 4.1 version.
What's new in version 4.1.1?
In version 4.1.1 some minor bugs have been fixed.
- Minor bug fixes in Utils
What's new in version 4.1.0?
In version 4.1.0 the dependency biobb_common has been updated to 4.1.0 version.
- Update to biobb_common 4.1.0 (general)
What's new in version 4.0.0?
In version 4.0.0 the dependency biobb_common has been updated to 4.0.0 version. Also Autodock Vina has been updated from 1.1.2 to 1.2.3.
- Update to biobb_common 4.0.0 (general)
- Update to Vina 1.2.3 (vina module)
What's new in version 3.9.0?
In version 3.9.0 the dependency biobb_common has been updated to 3.9.0 version.
- Update to biobb_common 3.9.0 (general)
- All inputs/outputs are checked for correct file format, extension and type (general)
What's new in version 3.8.1?
In version 3.8.1 the AutoDockVinaRun and FPocketRun tools have added the ability to be executed through docker.
- Added docker containers for AutoDockVinaRun and FPocketRun tools
What's new in version 3.8.0?
In version 3.8.0 the dependency biobb_common has been updated to 3.8.1 version.
- Update to biobb_common 3.8.0 (general)
What's new in version 3.7.1?
In version 3.7.1 some minor bugs have been fixed.
- Minor bug fixes in AutoDockVinaRun
What's new in version 3.7.0?
In version 3.7.0 the dependency biobb_common has been updated to 3.7.0 version.
- Update to biobb_common 3.7.0 (general)
What's new in version 3.6.0?
In version 3.6.0 the dependency biobb_common has been updated to 3.6.0 version.
- Update to biobb_common 3.6.0 (general)
What's new in version 3.5.1?
In version 3.5.1 the tools fpocket and autodock_vina have been renamed to fpocket_run and autodock_vina_run in order to avoid conflicts with the wrapped softwares.
- Tools fpocket and autodock_vina renamed to fpocket_run and autodock_vina_run
What's new in version 3.5.0?
The version 3.5.0 is the first release of biobb_vs. There have been added the fpocket and autodock-vina tools as well as utilities for getting a binding site, calculate box or extract a desired model from a PDBQT file.
- First release
- Fpocket module: FPocket, FPocketFilter and FPocketSelect tools
- Vina module: AutoDockVina tool
- Utils module: BindingSite, Box, BoxResidues and ExtractModelPDBQT tools