diff --git a/PKG-INFO b/PKG-INFO index 897ba8156..a39bb1034 100644 --- a/PKG-INFO +++ b/PKG-INFO @@ -1,6 +1,6 @@ Metadata-Version: 1.1 Name: ProDy -Version: 2.0 +Version: 2.1.0 Summary: A Python Package for Protein Dynamics Analysis Home-page: http://www.csb.pitt.edu/ProDy Author: James Krieger, She Zhang, Hongchun Li, Cihan Kaya, Ahmet Bakan, and others @@ -95,4 +95,4 @@ Requires: numpy (>=1.10) Requires: pyparsing Requires: biopython Requires: scipy -Provides: prody (2.0) +Provides: prody (2.1.0) diff --git a/docs/release/v2.0_series.rst b/docs/release/v2.0_series.rst index 10861e3ed..092e159b0 100644 --- a/docs/release/v2.0_series.rst +++ b/docs/release/v2.0_series.rst @@ -4,6 +4,36 @@ ProDy 2.0 Series .. contents:: :local: +2.1.0 (April 8, 2022) +------------------------------------------------------------------------------ + +**New Features**: + +*Integration with Scipion* + + * New functions :function:`.parseScipionModes`, :function:`.writeScipionModes` + and :function:`.calcScipionScore` + + * New argument *--export-scipion* (*-S*) in prody apps + +*Other* + + * Added :function:`.assignBlocks` for assigning blocks for RTB + + * Added mmCIF header parsing to create the same header dictionary as PDB header, + including secstr information and biomolecular assembly building + + * New arguments for prody apps, including altloc, zeros, sparse, kdtree and turbo + +**Bug Fixes and Improvements**: + + * Improvement to cealign mapping to be faster for protein only alignment + + * Bug fix for writing psf files + +**Full Changelog**: https://github.com/prody/ProDy/compare/v2.0.2...v2.1.0 + + 2.0.2 (February 17, 2022) ------------------------------------------------------------------------------ diff --git a/prody/__init__.py b/prody/__init__.py index f9602463b..251525d4b 100644 --- a/prody/__init__.py +++ b/prody/__init__.py @@ -1,6 +1,6 @@ """ProDy is a package for Protein Dynamics, Sequence, and Structure Analysis""" -__version__ = '2.0.2' +__version__ = '2.1.0' __release__ = __version__ # + '-dev' # comment out '-dev' before a release import sys