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Internet Electronic Conference of Molecular Design 2004
IECMD 2004, November 29 - December 12 IECMD 2004, Day 4, December 2
1. IECMD 2004, paper 33
Density Functional Study on the Highest and Lowest Spin States
of [Mn2O2(H2O)8]q+
(q = 0, 2, 4)
Masaki Mitani
, Takeharu Katsurada
, Yohei Wakamatsu
, and Yasunori Yoshioka
2. IECMD 2004, paper 29
Syn-2,7-disilatetracyclo[6.2.1.13,602,7]dodec-2(7)-ene:
Structural Influence of Incorporation of Disilene
into Sesquinorbornene Framework: A DFT Study
Davor Margetic
, Mario Vazdar
, and Mirjana Eckert-Maksic
3. IECMD 2004, paper 32
Modeling Structure Property Relationships with Kernel Recursive Least Squares
Rajshekhar
, Abhijit Kulkarni
, Valadi K. Jayaraman
, and Bhaskar D. Kulkarni
4. IECMD 2004, paper 44
QSAR Study on 5-N-Substituted-2-(Substituted Benzenesulphonyl)
Glutamines as Antitumor Agents through Synthesis and
Biological Evaluation: Part III
Bikash Debnath
, Soma Samanta
, Shovanlal Gayen
, Anindya Basu
, Balaram Ghosh
, and Tarun Jha
5. IECMD 2004, paper 14
Property-Based Design Methodology I: Parameters Influencing Solubility
R. DeWitte
, E. Kolovanov
, and F. Gorohov
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