tclick / python-fluctmatch / 21

Builds Branch Commit Type Ran Committer Via Coverage
21 master Finish fluctmatch-3.0.0 push Timothy Click travis-ci pending completion   set done
20 develop Switched from using concurrent.futures to multiprocessing. Added additional output during fluctuation matching. Added a command-line interface with several subcommands. Added licnese to front of each file. Reformatted to 80-columns. Removed some u... push Timothy Click travis-ci pending completion   set done
19 develop Added possibility of class descriptions for models. Signed-off-by: tclick <tcthepoet@yahoo.com> push tclick travis-ci pending completion   set done
18 develop Added ability to make subdirectories for storage. Added multiple choices for CG conversion. Signed-off-by: tclick <tcthepoet@yahoo.com> push tclick travis-ci pending completion   set done
17 develop Changed method names in the commands module. Signed-off-by: tclick <tcthepoet@yahoo.com> push tclick travis-ci pending completion   set done
16 develop Updated package requirements. Added command-line options and subcommands. Signed-off-by: Timothy Click <tcthepoet@yahoo.com> push Timothy Click travis-ci pending completion   set done
15 develop Combined charmm36_nma and charmm_nma. Added ability to split all-atom trajectory via CHARMM or Gromacs. Changed default output directory for fluctmatch operations. Changed version recognition for parameter output because c35 can use FLEX parameter... push Timothy Click travis-ci pending completion   set done
14 develop Fixed a bug in the ParamReader class. Added the ability to read and write .par files (similar to .prm) Added index sorting to the ParamTable class. Moved certain parameters from class to object attributes in the fluctmatch module. Signed-off-by: ... push Timothy Click travis-ci pending completion   set done
13 develop Added a base function to create an ENM. Fixed a bug in the Merge function. push tclick travis-ci pending completion   set done
12 develop Fixed a bug in the ParamTable class. push tclick travis-ci pending completion   set done
11 develop Lowered the tolerance level in charmmfluctmatch. Added a paramtable analysis class. Signed-off-by: Timothy Click <tcthepoet@yahoo.com> push Timothy Click travis-ci pending completion   set done
10 develop Fixed code to reflect the changes in analysis calculations. Signed-off-by: Timothy Click <tcthepoet@yahoo.com> push Timothy Click travis-ci pending completion   set done
9 develop Fixed bugs in the file classes. Derived classes from MDAnalysis.analysis.base.AnalysisBase. Fixed a bug in the CHARMM36 input file. Fixed some bugs in the core fluctuation matching code. Fixed a calculation bug in the trajectory code. Signed-off-... push Timothy Click travis-ci pending completion   set done
8 develop Updated documentation. Changed relative to absolute imports in enm module. Signed-off-by: Timothy Click <tcthepoet@yahoo.com> push Timothy Click travis-ci pending completion   set done
7 develop Changed all relative imports to absolute imports. Signed-off-by: Timothy Click <tcthepoet@yahoo.com> push Timothy Click travis-ci pending completion   set done