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Releases: m3g/topolink

16.343

08 Dec 17:08
@m3g m3g
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16.343 Pre-release
Pre-release
  • added link to changelog to release.sh
  • Changed version file to 16.343
  • changed interdomain to interchain
  • added interdomain option to compute only inter-domain(chain) links
  • changed error to warning when a linktype does not correspond to any atom. Added attention sign at the end.
  • added default chain=0 if the chain is not specified.
  • added change log to release.sh

16.341

06 Dec 15:26
@m3g m3g
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16.341 Pre-release
Pre-release
  • Changed version file to 16.341
  • fixed bug in remove_path
  • removed unused variables
  • prints link atoms with linker to facilitate visualization

16.333.2

28 Nov 21:02
@m3g m3g
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16.333.2 Pre-release
Pre-release
  • Changed version file to 16.333.2
  • increased precision of dbond to convergence and sigma of chain atoms
  • added extended path for other atoms than CA, and now only exits if dbond_maxviol is satsified.
  • fixed bug in setsigma and skip all atoms if the reference is N, C or O
  • fixed skip and call of goverlapcell (important)
  • fixed title format

16.333

28 Nov 18:21
@m3g m3g
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16.333 Pre-release
Pre-release
  • Changed version file to 16.333
  • fixed initialization of seed
  • prints accessibility by residue instead of by atom
  • prints file of residue accessibility to solvent
  • changed mimic sigma to 1.5
  • fixed initialization of accessiblity of link atoms
  • implemented mimicchain
  • prints accessibility of atoms
  • fixed output format for non-accessible links
  • calling solventaccess
  • fixed calling of skip in main program
  • solventaccess working fine
  • removed temporary file
  • trying to implement a more sofisticated way to recognize solvent accessibility
  • adding routine for determining solvent accessibility

16.330.2

28 Nov 18:23
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16.330.2 Pre-release
Pre-release
  • Changed version file to 16.330.2
  • fixed calling of setskip
  • fixed bug in string length

16.330

28 Nov 18:24
@m3g m3g
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  • Changed version file to 16.330
  • removed old skipping from overlapcell routines
  • added setskip routine
  • removed blank line
  • added gitingore file
  • replaced file_operations with newer version