isambard-uob/isambard issues and pull requests

#21 - Simplify Installation

Issue - State: open - Opened by universvm 12 months ago

#20 - scwrl4 compatability on Macs

Issue - State: open - Opened by wdawson14 almost 2 years ago

#19 - 'gbk' codec can't decode byte 0x93 in position 4728: illegal multibyte sequence

Issue - State: open - Opened by FengChunsong666 about 3 years ago - 1 comment

#18 - Bumps version number.

Pull Request - State: closed - Opened by ChrisWellsWood over 3 years ago

#17 - Fixes a bug in DSSP output parsing

Pull Request - State: closed - Opened by ChrisWellsWood over 3 years ago

#16 - Is there a way to generate all register combinations for a given dimer?

Issue - State: closed - Opened by jmrussell over 4 years ago - 13 comments

#15 - How to generate an anti-parallel coiled-coil of 4 chains?

Issue - State: open - Opened by xiaotianzhou1982 over 4 years ago - 1 comment

#14 - Packing density branch

Pull Request - State: closed - Opened by kls93 about 6 years ago - 1 comment

#13 - Finding H-bonds and KIHs with Isambard2

Issue - State: open - Opened by broncio123 about 6 years ago - 1 comment
Labels: enhancement

#12 - isambard and budeff installation through pip

Issue - State: closed - Opened by broncio123 about 6 years ago - 1 comment

#11 - Conda installation

Issue - State: open - Opened by eric-jm-lang over 6 years ago - 1 comment
Labels: enhancement, help wanted

#10 - Make variable for Scwrl executable path.

Issue - State: open - Opened by ChrisWellsWood over 6 years ago - 1 comment
Labels: enhancement, good first issue

#9 - Getting the z_shift in pacc

Issue - State: open - Opened by ajasja over 6 years ago

#8 - Fixed pacc functionality for antiparallel CCs as well.

Pull Request - State: closed - Opened by ajasja over 6 years ago - 6 comments

#7 - Fixes overcompensation for -ve dihedral.

Pull Request - State: closed - Opened by ChrisWellsWood over 6 years ago

#6 - Migrated pacc functionality from old ISAMBARD version.

Pull Request - State: closed - Opened by ajasja over 6 years ago - 2 comments

#5 - Example analysis of antiparallel dimer

Issue - State: closed - Opened by ajasja over 6 years ago - 4 comments

#4 - Features to port from versions prior to 2.0.0.

Issue - State: open - Opened by ChrisWellsWood over 6 years ago
Labels: enhancement

#3 - add_ons missing

Issue - State: closed - Opened by ajasja over 6 years ago - 9 comments

#2 - Trouble finding documentation