From c87087c34cd4aa1f84c254860f8f9b7ff1ee816d Mon Sep 17 00:00:00 2001 From: yaz62 Date: Sun, 7 Feb 2021 10:40:18 -0500 Subject: [PATCH 1/3] minor changes --- prody/dynamics/exanm.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/prody/dynamics/exanm.py b/prody/dynamics/exanm.py index 3219a827c..b81cf4e0d 100644 --- a/prody/dynamics/exanm.py +++ b/prody/dynamics/exanm.py @@ -38,7 +38,7 @@ def __init__(self, name='Unknown'): self._combined = None def buildMembrane(self, coords, **kwargs): - """Build Hessian matrix for given coordinate set. + """Build membrane lattice around **coords**. :arg coords: a coordinate set or an object with ``getCoords`` method :type coords: :class:`numpy.ndarray` From 452b36892bbe58d1282c6328a83a84c31abc0889 Mon Sep 17 00:00:00 2001 From: yaz62 Date: Sun, 7 Feb 2021 10:46:41 -0500 Subject: [PATCH 2/3] updated version number --- PKG-INFO | 4 ++-- prody/__init__.py | 2 +- 2 files changed, 3 insertions(+), 3 deletions(-) diff --git a/PKG-INFO b/PKG-INFO index e192f45cf..897ba8156 100644 --- a/PKG-INFO +++ b/PKG-INFO @@ -1,6 +1,6 @@ Metadata-Version: 1.1 Name: ProDy -Version: 1.11 +Version: 2.0 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 (1.11) +Provides: prody (2.0) diff --git a/prody/__init__.py b/prody/__init__.py index 97a5c8cdc..ba1a38861 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__ = '1.11' +__version__ = '2.0' __release__ = __version__ # + '-dev' # comment out '-dev' before a release import sys From eff98c1c58162b40b7d13a666ca10587a4196854 Mon Sep 17 00:00:00 2001 From: yaz62 Date: Sun, 7 Feb 2021 10:57:02 -0500 Subject: [PATCH 3/3] minor fix --- prody/proteins/compare.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/prody/proteins/compare.py b/prody/proteins/compare.py index eb3057d6c..36a4e397b 100644 --- a/prody/proteins/compare.py +++ b/prody/proteins/compare.py @@ -1381,7 +1381,7 @@ def _findAlignment(sequence, alignment): def getCEAlignMapping(target, chain): try: from .ccealign import ccealign - except: + except ImportError: LOGGER.warn('Could not import ccealign C/C++ extension.' 'It may not be installed properly.') return None