trajectory analysis

From: Sue Heavner <>
Date: Sat 13 Oct 2001 15:26:41 -0400

Dear Reflector:
I wish to find all protons that come within a certain distancd (say 3 angstroms) from a specified atom (another proton) during a md run. I tried to use cutres in carnal but it seems that option will only give me residues as in monomers and not specific atoms even though ii tried specifying a second group of atom type H*. Is there some way to obtain this information? Thank-you, Sue
Received on Sat Oct 13 2001 - 12:26:41 PDT
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