On 18 May, Rajarshi Guha wrote: > Will these be 2D structure diagrams? Or ray traced 3D images? If the > former what is the need to store these? They could be easily > generated on the fly (either by local software or by web services > such as http://rguha.ath.cx:8080/cdkws/services/StructureDiagram? > wsdl). If the latter, what is the utility of static 3D images (apart > from the eye-candy aspect)
Quick access in the browser window is the answer, accessible to anyone without special configuration. I haven't decided on line v. rendered diagrams. Maybe both. > You can get 3D coordinates for most of PubChem from http:// > www.chembiogrid.org/cheminfo/p3d - depending on the mode of access > (such as bulk downloads) you can get access to the underlying > database if needed. Thanks for the suggestions! Regards, Michael L. Love > ------------------------------------------------------------------- > Rajarshi Guha <[EMAIL PROTECTED]> > GPG Fingerprint: 0CCA 8EE2 2EEB 25E2 AB04 06F7 1BB9 E634 9B87 56EE > ------------------------------------------------------------------- > A sine curve goes off to infinity, or at least the end > of the blackboard. > -- Prof. Steiner > -- Visit proclus realm! http://proclus.tripod.com/ -----BEGIN GEEK CODE BLOCK----- Version: 3.1 GMU/S d+@ s: a+ C++++ UBULI++++$ P+ L+++(++++) E--- W++ N- !o K- w--- !O M++@ V-- PS+++ PE Y+ PGP-- t+++(+) 5+++ X+ R tv-(--)@ b !DI D- G e++++ h--- r+++ y++++ ------END GEEK CODE BLOCK------
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