Releases: m3g/topolink
Releases · m3g/topolink
19.156
05 Jun 18:26
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Changed version file to 19.156
removed test file
ignores alternate residue conformations
deallocate newset in remove routines
updated input for ignore missing residues
added ignore_missing_residues option
mirror correlation in output
fixed reading log in new format
19.066
07 Mar 13:37
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Changed version file to 19.066
improved correlation
fixed bug
added test for phi den
fixed printing and added type=5
fixed diagonal of n11
updated rules
Merge branch 'master' of https://github.com/leandromartinez98/topolink
added example log files
udpated julia link
fixed typos
removed uncessary using plots
removed labels
updated examples
now it reads dirs too
added correlation
added linkresult and updated readme
added linkensemble and improved readme
small changes
fixed name function and exported functions
Create README.md
added simpleget functions
added linkensemble
fixed typo and added show for LinkAtom
reestructued the code to read all data for each model
added isequal functions to residues and links
improved multiple log data structure and show functions
added logs to module
fixed typo in comment
added function to read multiple logs from log list
added function to read topolink log file
computes gscore as energy
organized files
splitted code into various files
added scores function
fixes in analysis
added initial commit of julia analysis tools
19.032
01 Feb 17:27
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Changed version file to 19.032
added iguess=2 as default in main file
added iguess=2 as default in example
removed wrong definition of dsearch introduced in 18.263
returned iguess=1 to default
updated title
updated reference
19.020
20 Jan 12:29
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Changed version file to 19.020
fixed reading output in linkcorrelation
fixed reading output in filtermodels
fixed reading output in linkensemble
fixed reading output files in evalmodels
added reference
18.336
02 Dec 23:22
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Changed version file to 18.336
changed PDB to structure for consistency
removed test files
fixed some bugs in mmCIF, working now
added support for mmCIF (not tested yet)
release information
prints links with different colors depending on result
18.335
01 Dec 19:34
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Changed version file to 18.335
implemented printPDBnotfound option
removed spurious .exrc file
18.324
20 Nov 18:39
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Changed version file to 18.324
prints names of input and log files
18.284
11 Oct 19:48
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Changed version file to 18.284
fixed space in logs to back server parser compatibility
added static compilation option to Makefile
18.269
26 Sep 19:43
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Changed version file to 18.269
fixed double printing of links in screen
18.263
20 Sep 14:49
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updated gitignore file to ignore .log files
removed teste.log file
Changed version file to 18.263
removed possibility of supressing screen log
added printing to log file if desired
changed url of git in release.sh
changed distance values in input file example for DSS
implementing iguess=3, arch ready
changed comment of link_to_pdb.f90 file
fixed initial guess generation
moved the link_to_pdb code to individual function
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