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reaction modeling

David Fell daf at bms.brookes.ac.uk
Wed Aug 31 04:51:19 EST 1994


Patrick Swann wrote:

>I'm looking for software that can determine product yields from multiple
>(possibly branching) reactions if given rate constants and initial substrate
>concentrations.  Any ideas would be appreciated.
>

>From the outline description of the problem, it seems that many simulators 
would be able to cope.  However, the problem could be easily entered into 
biochemical reaction simulators that take the reactions as input, construct 
the differential equations and give the output in a form suitable for 
graphing.  Possibilities described in this news group in the past include 
SCAMP, GEPASI and METAMODEL.  Program code for PCs (and some documentation) 
are available by anonymous ftp from the archive at bmsdarwin.brookes.ac.uk 
(161.73.104.10).

David Fell

=========================================================

David Fell,
School of Biological & Molecular Sciences,
Oxford Brookes University,
Oxford OX3 0BP,
UK

daf at bms.brookes.ac.uk




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