Releases · prody/ProDy

2.0.1 (Dec 20, 2021)

New Features:

Added :function:.calcRWSIP for comparing sets of modes
New methods to convert :class:.Atom, :class:.Atomic and :class:.EMDMAP
to TEMPy objects, allowing calculations such as cross-correlation coefficient (CCC)
to EM maps.
Added :func:.calcDynamicFlexibilityIndex and :func:.calcDynamicCouplingIndex
for further interpretation of PRS results.
Reinstated the option of using forces in PRS as in ProDy v1.8 (turbo=**False**)
Added GitHub Actions Continuous Integration in place of Travis.

Bug Fixes and Improvements:

Compatibility and bug fixes for various functions, including pyparsing for selections.
Extended :class:.AdaptiveANM to work with other models including explicit membrane
ANM, :class:.exANM.
Improved capabilities for fetching and parsing mmCIF and EMD files.
Improved handling of residue and serial numbers including hexadecimal and hybrid36 formats.
Consistency fixes.
More non-standard amino acids (MEN, CSB, CME).

Full Changelog: v2.0...v2.0.1