Dear user, This program is FULL of BUGS and I DO NOT assume any responsability on the consequences of its use. (it is not THAT dangereous) USE IT AT YOUR OWN RISK. _______________________________________________________________________________ FILE YOU SHOULD HAVE: README this file INSTALL csh installation script pdbv_IRIX405 executable for IRIX 4.0.5 pdbv_IRIX53 executable for IRIX 5.3 pdbv.z packed pseudo-man page _______________________________________________________________________________ INSTALLATION: To install the program follow the steps: - Edit the file INSTALL and modify the following two lines in it: set PDBV_BINPATH = /usr/local/bin set PDBV_MANPATH = /usr/local/man/cat1 changing the directories to whatever you want. - execute the script INSTALL specifying the IRIX operating system you are using in the following way: % ./INSTALL 405 % ./INSTALL 53 if the IRIX 5.3 version does not work on your machine you can try the IRIX 4.0.5. NOTE: you should be SuperUser (root) to install the program Any comments, please feel free to send me e-mail. _______________________________________________________________________________ SHORTS ON USING PDBV: Start the program by typing: % pdbv -f file.pdb where file.pdb is your molecular model in the PDB format. The program will create at startup 3 standard objects which can be interactively toggled with the FUNCTION keys: F7 = Suporting C-alpha (trace that is NOT modifiable by the user), F1 = C-alphas, F2 = backbones and F3 = all-PROTEIN-atoms-in-PDB This program also allows the user to create a secondary window to display the Ramachandran plot of the molecule being viewed. Actually the plot starts empty (you must click inside as soon as the window is placed in your desktop) and a pop-up menu is available in the window that allows the user to chose between the plot background (either theoric areas or procheck statistics). Besides allowing the user to rotate-translate-scale-slab-etc with some complicated mouse button combinations it is also possible to pick atoms (there is a four [4] atom buffer; last four picked atoms) and to do measures with them (e.g. distance, dihedral, neighbours and Hbonds [very nasty, it is not really H-bonds, it just checks for the atom types and for the distance] ). Things that are hard to do on most mol/graph packages can easily be done with pdbv. For example, you can pick an atom, press "a" on the keyboard and you're presented with a sphere of atoms within 10 A of the picked atom (the 10A cutoff can be changed with the arrow-keys). Also after picking an atom you can press "s" for a sidechain, "r" for the residue, "o" for the neighbours and lots more. The program also allows you to insert text and shapes (rectangles, ellipses and lines, filled or not). After chosing insert text or edit text, wait until a floating prompt appears. The edit/text function allows only to change color/size/font of the text NOT the TEXT. Also you can put accents on some letters, but not all accents, only those used in portuguese (which is my native language). _______________________________________________________________________________ COMMENTS AND BUGS: If you want to send me comments, put them in a PostCard and send it to my AIR-MAIL address. Well, if you don't want to send me the postcard you can send the comments by e-mail. _______________________________________________________________________________ HOW TO FIND ME: Ezequiel Horacio Panepucci <-- This is ME, but you can call me Zac E-MAIL: zac@ifqsc.sc.usp.br PHONE: 55-162-74-9204 FAX: 55-162-71-3616 AIR-MAIL: Grupo de Cristalografia DFI / IFSC / USP Av. Dr. Carlos Botelho, 1465 - Centro C.P.: 369 Sao Carlos - SP Brasil