Model Evaluation: Difference between revisions

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(New page: CastP - Volume and surface calculation of pocket or cavity CASTp - webserver for identification and measurements of surface accessible pockets as well as interior DIMPLOT - Interactions b...)
 
(more details for ligplot according to ccp4bb posts)
 
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CastP - Volume and surface calculation of pocket or cavity
* [http://www.ccp4.ac.uk/dist/html/sfcheck.html sfcheck] -   run CCP4Online sfcheck
CASTp - webserver for identification and measurements of surface accessible pockets as well as interior  
* [http://sts.bioengr.uic.edu/castp/index.php CASTp] - webserver for identification and measurements of surface accessible pockets as well as interior  
DIMPLOT - Interactions between monomers of a dimer
* [http://www.biochem.ucl.ac.uk/bsm/ligplot/manual/man8.html DIMPLOT ]- Interactions between monomers of a dimer
FADE and PADRE - Shape and Complementarity Server
* [http://www.sdsc.edu/CCMS/FP/index.html FADE and PADRE ]- Shape and Complementarity Server
GRASP - Runs on Sundance (unix) only
* [http://wiki.c2b2.columbia.edu/honiglab_public/index.php/Software:GRASP GRASP] - Calculate electrostatic potential
LIGPLOT - Interactions around a ligand of piece of structure
* [http://www.biochem.ucl.ac.uk/bsm/ligplot/ligplot.html LIGPLOT] - Interactions around a ligand of piece of structure. There is also LigPlot+ at http://www.ebi.ac.uk/thornton-srv/software/LigPlus/; the [http://www.ebi.ac.uk/pdbsum/ PDBsum] server internally runs ligplot and returns pdf files; non-released PDB files can be handled using the "generate" option in the left panel
NACCESS - Surface area calculaitons, per residue, or atom
* [http://www.bioinf.manchester.ac.uk/naccess/ NACCESS] - Surface area calculaitons, per residue, or atom
NCONT - (ccp4) analyses contacts between subsets of atoms in a PDB file
* [http://www.ccp4.ac.uk/dist/html/ncont.html NCONT ] - (ccp4) analyses contacts between subsets of atoms in a PDB file
Protein Interaction Server - to obtain surface calculations
* [http://www.biochem.ucl.ac.uk/bsm/PP/server/ Protein-Protein Interaction Server] - stats on your chain interfaces and  to obtain surface calculations
Protein-Protein Interaction Server - stats on your chain interfaces
* [http://skuld.bmsc.washington.edu/parvati/parvati.html PARVATI] - anisotropic displacement parameters statistics
PARVATI anisotropic displacement parameters statistics
* [http://www.ccp4.ac.uk/newsletters/newsletter38/03_surfarea.html SURFACE and AREAIMOL] -  (ccp4) -surface programs
SURFACE and AREAIMOL (ccp4) -surface programs
* [http://alpha2.bmc.uu.se/~gerard/manuals/gerard_manuals.html VOIDOO] - look for interior cavities
VOIDOO - look for interior cavities, volumes of particular cavities (like active sites)
* [http://redpoll.pharmacy.ualberta.ca/vadar/ VADAR ] - (Volume, Area, Dihedral Angle Reporter)
VADAR (Volume, Area, Dihedral Angle Reporter)
 
 
 
 
 
 
 
 
STING Millenium - web-based suite of programs for visualizing molecular structure and comprehensive structure analysis:inaccessible cavities

Latest revision as of 09:54, 27 August 2010

  • sfcheck - run CCP4Online sfcheck
  • CASTp - webserver for identification and measurements of surface accessible pockets as well as interior
  • DIMPLOT - Interactions between monomers of a dimer
  • FADE and PADRE - Shape and Complementarity Server
  • GRASP - Calculate electrostatic potential
  • LIGPLOT - Interactions around a ligand of piece of structure. There is also LigPlot+ at http://www.ebi.ac.uk/thornton-srv/software/LigPlus/; the PDBsum server internally runs ligplot and returns pdf files; non-released PDB files can be handled using the "generate" option in the left panel
  • NACCESS - Surface area calculaitons, per residue, or atom
  • NCONT - (ccp4) analyses contacts between subsets of atoms in a PDB file
  • Protein-Protein Interaction Server - stats on your chain interfaces and to obtain surface calculations
  • PARVATI - anisotropic displacement parameters statistics
  • SURFACE and AREAIMOL - (ccp4) -surface programs
  • VOIDOO - look for interior cavities
  • VADAR - (Volume, Area, Dihedral Angle Reporter)