Hi everyone,
The new 1.0.b17 release of the FormatConverter is now available for
download.
Please see the 'New chemComp structure' mail for more information about
the chemComp changes. This should not affect you unless you have
downloaded chemComps that are not included in the standard distribution.
Other changes/additions besides smaller bug fixes:
- readSequence has been completely reworked and now allows reorganization
of original data and selection of chemCompVars (e.g. protonated ARG, ...).
- DYANA/CYANA sequence import/export now takes ARG+, ... into account.
Cis bonds are also tracked.
- Added TALOS dihedral constraints import (from TALOS output file) and
project export (writes TALOS input file)
- Updated project reading/writing for all formats
- All windows should now include the project name
- Bug fix: It is now possible to use existing experiments when reading
peak lists.
Have fun,
Wim.
----------------------------------------------------------------------
Wim Vranken [log in to unmask]
Macromolecular Structure Database (MSD) group
European Bioinformatics Institute (EMBL outstation)
Wellcome Trust Genome Campus
Cambridge CB10 1SD, UK
Tel: +44-1223-494682 Fax: +44-1223-494487
----------------------------------------------------------------------
|