[Chimera-users] new Chimera snapshot release
Charles Moad
cmoad at indiana.edu
Tue Oct 19 11:13:25 PDT 2004
The release notes include: initial OpenGL Shading Language API support.
Do you have any documentation on how you expose this functionality, or
could you offer a brief explanation on how you see it being integrated?
Thanks,
Charlie
On Fri, 2004-10-08 at 19:44, Eric Pettersen wrote:
> Hi all,
> A new Chimera snapshot release (version 1.2029) is now
> available for download. I've summarized the major changes since the
> last release (1.1951) below. A list of _all_ the changes since the
> last release is in the release notes:
> http://www.cgl.ucsf.edu/chimera/docs/relnotes/1.2029.html
>
> Eric Pettersen
> UCSF Computer Graphics Lab
> pett at cgl.ucsf.edu
> http://www.cgl.ucsf.edu
>
> General changes
> ---------------
>
> The "web fetch" part of the "File...Open" dialog has been split off
> into its own "Fetch by ID" dialog. The Fetch dialog now supports
> fetching NDB IDs.
>
> Labels are now offset in the viewing coordinate system (rather than the
> model coordinate system), making them much less likely to be obscured.
>
> Moved C3' off of ribbon backbone so that the sugar ring isn't distorted.
>
>
> New Tools
> ---------
>
> Nucleotides (Graphics): create various nucleotide-specific depictions,
> such as stylized representations of base pairings or filled sugar rings
>
> Define Attribute (Utilities, Programming): assign values to new or
> existing attributes of atoms, residues, or models. Particularly useful
> in conjunction with the Render by Attribute tool.
>
>
> Tool Changes
> ------------
>
> AddH improved to avoid steric clashes (and appears in model panel)
>
> Match -> Align can handle circular permutations in multiple alignments
> [formerly only in pairwise]
>
> Movie can read PSF/DCD files from CHARMM, NAMD, and X-PLOR; can read
> PDB-format trajectories (single concatenated file or one file per
> frame)
>
> Multalign Viewer can save a subset of an alignment to a file
>
> Multiscale Models includes the zone-selection options Near and Contacts
>
> PipesAndPlanks now connects the secondary structure elements with loops
>
> Web Data preference category renamed to Web Access and includes HTTP
> proxy options
>
> Render by Attribute implements Radii section (atom radius scales with
> attribute value) and Worms section ("worm" ribbon radius scales with
> attribute value)
>
> Ribbon Style Editor scalings are now treated similarly to cross
> sections (per-residue, no startup default except in New Molecules
> preferences); new "residue class" tab allows specification of which
> atoms should guide the ribbon, this generalizing ribbons to polymers
> other than standard peptides and nucleic acids
>
> ViewDock includes new interface for choosing compounds by descriptor
> values
>
>
> New Commands
> ------------
>
> addaa: add amino acids to the C-terminus of a peptide/protein
>
> addh: add hydrogens (command implementation of AddH)
>
> bond/~bond: create and delete bonds
>
> chirality: report the R/S configuration of a chiral center (see User's
> Guide for caveats)
>
> defattr: define a new attribute and/or assign attribute values (command
> implementation of Define Attribute)
>
> rangecolor: color over a range according to attribute values
>
> rmsd: evaluate the RMSD between specified sets of atoms (without
> matching)
>
>
> Command Changes
> ---------------
>
> atom specification operators added for union (|) and negation (~)
> [previously just intersection (&) and operators for combining
> attributes]
>
> hbonds has "tilde version" (~hbonds) which removes the pseudobonds
> showing hydrogen bonds
>
> labelopt info has "res" or "residue" keyword indicating that only
> residue name and number should be shown (not atom name)
>
> rainbow can color by model (previously only by residue or chain);
> likewise for Rainbow tool
>
> select has "up" or "down" arguments which behave like up-arrow and
> down-arrow to broaden and narrow a pre-existing selection
>
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>
>
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