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qmol-0.4.1-w32.zip 2013-03-12 2.9 MB
qmol-0.4.1.tar.bz2 2013-03-12 46.6 kB
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Version 0.4.1.2: Added hungarian translation (thanks to Attila László Főző)

Version 0.4.1.1: Fixed memleaks (Ticket #1)

Version 0.4.1: Windows: fixed unnecessary opening of console window

Version 0.4.0: Added predefined groups (amino acids, alkyls/aryls) Added 1-letter amino acid codes interpreting in [] Added protein mode Added output item: number of amino acids Made subtraction of formulas with - possible Made GUI result output configurable like command line output Added window size/position restoring for options and group definitions Fixed w32 console output

Version 0.3.4: Fixed w32 crash Made group definition as weight possible ('Element definition')

Version 0.3.3: Made 0 coefficients possible Fixed row indices in error messages Fixed deletion of defined group(s) not applied when clicking 'Done' Added german translation

Version 0.3.2: Added command line calculation

Version 0.3.1: fixed segfault in group definitions window

Version 0.3: Added subscripts/coloring of coefficients added history reversing added summation weights of multiple selected history entries added preferences dialog added a completer to formula input improved display of fractional coefficients

Version 0.2: Added parsing of multicomponent formulas (separated by +) added Help Menu; added About dialog

Version 0.1.1: added documentation (html)

Version 0.1: Ready for daily use: molecular weights can be calculated and custom groups can be defined.

Source: README.md, updated 2014-03-04