An Attempt Judging Possibility of Synthesis Routes from the TOSP Program Using DFT Calculations.

Author:

Hori Kenzi1,Okano Katsuhiko2,Yoshimura Kazuaki1,Nishida Akiko1,Yamamoto Hidetoshi1

Affiliation:

1. Department of Applied Chemistry and Chemical Engineering, Faculty of Engineering, Yamaguchi University

2. Tokyo R&D Center, Daiichi Pharmaceutical Co. Ltd.

Publisher

Division of Chemical Information and Computer Sciences

Subject

General Medicine

Reference18 articles.

1. [1] Corey, J. E.; Cheng, X-M., The Logic of Chemical Synthesis, John Wiley & Sons, New York, 1989.

2. [2] Gasteiger, J., Chim. Ind.,(Milan), 64, 714 (1982).

3. [3] Funatsu, K.; Sasaki, S., Computer Chemistry Series 2, "AIPHOS", Kyoritsu Shuppan, 1994.

4. [4] Hori, K.; Yoshimura, K.; Ohno, H.; Onimura, K.; Ohishi, T., Tetrahedron, 59, 6301 (2003).

5. [5] Hori, K.; Sonoda, T.; Harada, M.; Yamazaki-Nishida, S., Tetrahedron, 56, 1429-1436 (2000).

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