Release notes for 3.4.x releases
- August 16th 2004 Marvin 3.4.3.
New mouse drag actions in sketcher:
templates can be rotated before putting in template mode,
two connected atoms can be placed in atom mode.
Bugfixes.
- August 05th 2005 Marvin 3.4.2. Bugfixes
- July 29th 2005 Marvin 3.4.1.
Calculator Plugin API usage
examples.
Reactivity plugin renamed to
Huckel
Analysis plugin. Bugfixes.
- July 1st 2005 Marvin 3.4.
- New formats:
ChemAxon Extended SMILES
and SMARTS,
Gaussian Cube.
Improved import/export in
MDL Molfile
(embedded S-group support),
SMILES, SMARTS,
Marvin Document
and CML formats.
- Improved pKa, logP, logD
calculation.
- New plugins:
Reactivity,
Hydrogen Bond Donor-Acceptor (HBDA),
Major Microspecies,
Refractivity
- GUI:
- S-group editing improvements. Amino acid templates can be put
on the screen in contracted state. Contracted groups with two
attachment points are connected properly (point 2
in group 1 to point 1 in group 2).
- Explicit lone pairs can be added to atoms.
- Atom symbol font and bond thickness can be set in Preferences.
- Graphics object properties can be set for many selected objects at
once.
- Automatic atom mapping (Edit/Atom Maps menu)
- Real-time
monitoring of the progress of command line molecular dynamics
simulations.
- 3D: More exact structures, faster generation.
Generating conformers (Edit/Clean/3D/Select conformer).