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Winokan, Max S Dr (PG/R - Maths & Physics)
GromacsOnEUREKA
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171e05903847ea8ea616f54fdc10da6776ca787c
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Created with Raphaël 2.2.0
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Fix link
master
master
Fixed links
Fixed links
merge
Mac support
svg2png
Archer2 XVG->SVG->PNG Fix
CP2K path comments
archer2 support
support for different executable names
Extract
Fixed help screen bug
More versions of gromacs supported.
y-log option
support for make_ndx and velacc
update
update
angle parameters
Added remove atom
Reworked termini
Typo in help screen
Clear format on echo
Merge branch 'master' of https://gitlab.eps.surrey.ac.uk/mw00368/GromacsOnEUREKA
Cleanup
Typo with search -sffb 4 atom typees
List errors on finishUp
Merge branch 'master' of https://gitlab.eps.surrey.ac.uk/mw00368/GromacsOnEUREKA
plot arbitrary PDBs
Minimal A*T* support
catch single errors
-sffb line numbers
bugs
Improvements to finishUp and gmxRet
-ffb
-srtp bugs
-srtp bugs
C36custom as default for -srtp, and cleanup
Support for ten column PDB, & more custom residue names
get rid of GMX backups in finishUp, better SELECT checking
Different definition for the res_string
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