Użytkowniczka:Ask: Różnice pomiędzy wersjami

Wersja z 06:52, 8 paź 2010

Agnieszka Kwiecień, WCSS.

Do za.

Xaim [1]
CFOUR [2]
SIESTA
DALI [3]
Mayavi [4]
MOPAC (stara wersja, .f, nowa płatna)
Rosetta [5]
ANSYS - dla mechaników, na razie udostępniamy licencję, w lutym przechodzimy na krajową i wtedy zaplanować inst.
pymol [6] (Molecular Graphics System PyMOL is a molecular graphics system targetted at medium to large biomolecules like proteins. It can generate high-quality publication-ready molecular graphics images and animations. Features include: * Visualization of molecules, molecular trajectories and surfaces of crystallography data or orbitals * Molecular builder and sculptor * Internal raytracer and movie generator * Fully extensible and scriptable via a Python interface. File formats PyMOL can read include PDB, XYZ, CIF, MDL Molfile, ChemDraw, CCP4 maps, XPLOR maps and Gaussian cube maps.)

Do akt. apl.

Do akt. opis

Do op.

Komercyjne:

@@ Linia 11: / Linia 11: @@
 * [[Rosetta]][http://www.rosettacommons.org/software/index.html]
 * [[ANSYS]] - dla mechaników, na razie udostępniamy licencję, w lutym przechodzimy na krajową i wtedy zaplanować inst.
-* [[pymol]] [http://www.pymolwiki.org]
+* [[pymol]] [http://www.pymolwiki.org] (Molecular Graphics System PyMOL is a molecular graphics system targetted at medium to large biomolecules like proteins. It can generate high-quality publication-ready molecular graphics images and animations. Features include:  * Visualization of molecules, molecular trajectories and surfaces of crystallography data or orbitals  * Molecular builder and sculptor  * Internal raytracer and movie generator  * Fully extensible and scriptable via a Python interface. File formats PyMOL can read include PDB, XYZ, CIF, MDL Molfile, ChemDraw, CCP4 maps, XPLOR maps and Gaussian cube maps.)
 Do akt. apl.
 * [[ProtoMol]] (2.1.1 -> 3.2)