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Pure Appl. Chem., 1998, Vol. 70, No. 7, pp. 1385-1394

http://dx.doi.org/10.1351/pac199870071385

Computer-assisted evaluation of anaerobic biodegradation products

G. Klopman, R. Saiakhov, M. Tu, F. Pusca and E. Rorije

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  • Karabunarliev S., Dimitrov S., Pavlov T., Nedelcheva D., Mekenyan O.: Simulation of chemical metabolism for fate and hazard assessment. IV. Computer-based derivation of metabolic simulators from documented metabolism maps. SAR and QSAR in Environmental Research 2012, 23, 371. <http://dx.doi.org/10.1080/1062936X.2011.645873>
  • Dimitrov S., Pavlov T., Dimitrova N., Georgieva D., Nedelcheva D., Kesova A., Vasilev R., Mekenyan O.: Simulation of chemical metabolism for fate and hazard assessment. II CATALOGIC simulation of abiotic and microbial degradation. SAR & QSAR in Env Res 2011, 22, 719. <http://dx.doi.org/10.1080/1062936X.2011.623322>
  • Dimitrov S., Pavlov T., Veith G., Mekenyan O.: Simulation of chemical metabolism for fate and hazard assessment. I. Approach for simulating metabolism. SAR & QSAR in Env Res 2011, 22, 699. <http://dx.doi.org/10.1080/1062936X.2011.623323>
  • Kümmerer Klaus: Sustainable from the very beginning: rational design of molecules by life cycle engineering as an important approach for green pharmacy and green chemistry. Green Chem 2007, 9, 899. <http://dx.doi.org/10.1039/b618298b>
  • Schüürmann Gerrit: Modellierung der Lebensdauer und Abbaubarkeit organischer Verbindungen in Luft, Boden und Wasser. Angew Chem 2005, 117, 834. <http://dx.doi.org/10.1002/ange.200462504>
  • Sedykh Aleksander, Saiakhov Roustem, Klopman Gilles: META V. A model of photodegradation for the prediction of photoproducts of chemicals under natural-like conditions. Chemosphere 2001, 45, 971. <http://dx.doi.org/10.1016/S0045-6535(01)00007-8>
  • Rorije E., Loonen H., Müller M., Klopman G., Peijnenburg W.J.G.M.: Evaluation and application of models for the prediction of ready biodegradability in the MITI-I test. Chemosphere 1999, 38, 1409. <http://dx.doi.org/10.1016/S0045-6535(98)00543-8>