Changelog#
v0.8.6 (2023-05-29)#
v0.8.5 (2023-05-26)#
update documetation
specify with lower bounds libraries versions
v0.8.4 (2023-05-26)#
v0.8.3 (2023-05-05)#
pyproject.toml added for pre-build specifications (Cython)
v0.8.2 (2023-03-29)#
v0.8.1 (2023-03-29)#
v0.8.0 (2023-03-28)#
PDB parser now has an option to avoid HETATM records
v0.7.0 (2023-03-27)#
adapt native contact map function to address those sequences that presents gaps.
v0.6.1 (2023-03-21)#
v0.6.0 (2023-03-20)#
Implement three new objects to store GE calculations: GE, GETermini and GEChain. GE collects the loop, the thread and the GE value of a loop calculation. GETermini object contains the GE` for the N- and C-threads. GEChain collects the output of pyge.singlechain.singlechain
v0.5.0 (2023-03-20)#
Integrate the computation of GE weighted (see publication) into the main function in gent
v0.4.0 (2023-03-20)#
v0.3.0 (2023-03-20)#
v0.2.0 (2023-03-20)#
v0.1.1 (2023-03-20)#
Implementation of a new singlechain function. Goal: provide a function to return GE values directly from a PDB file
Remove qentangled module because it is not used anymore
v0.1.0 (2022-12-15)#
First release