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Bridging the Gap between Stochastic and Deterministic Regimes in the Kinetic Simulations of the Biochemical Reaction Networks

✍ Scribed by Puchałka, Jacek; Kierzek, Andrzej M.


Book ID
118516004
Publisher
Biophysical Society
Year
2004
Tongue
English
Weight
310 KB
Volume
86
Category
Article
ISSN
0006-3495

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