| CINF | Monday, March 26, 2007 | ||
8:00 PM-10:00 PM Hyatt Regency Chicago -- Riverside Center, Sci-Mix | |||
Sci-Mix | |||
| Sponsored by: | CINF | ||
| Organizer: | Leah R. Solla | ||
| 99 | Accounting for 3-D descriptors of conformers in QSAR modeling Shaillay K Dogra, Achintya Das, Kalyanasundaram Subramanian | ||
| 37 | Novel cheminformatics study of non-peptidic HIV protease inhibitors using machine learning and statistical tools Barun Bhhatarai, Srinivas Alla, Chad R Bernier, Rajni Garg, Sunil Kumar | ||
| 79 | Developing semantic web service for chemical informatics Xiao Dong, David J Wild | ||
| 38 | Pharmacokinetic modeling of anti-HIV protease ritonavir analogs Raghava Chaitanya Kasara, Barun Bhhatarai, Rajni Garg | ||
| 39 | Understanding the effect of benchmark dataset composition on the validation and optimization of ligand based virtual screening using self-organizing maps Sebastian G. Rohrer, Knut Baumann | ||
| 40 | Data mining of NIH DTP human tumor cell line screen data for anticancer drug discovery Huijun Wang, David J Wild | ||
| 18 | Characterization of spectra and other analytical data via combination of two methods: Multivariate processing and overlap density heatmap visualization Gregory Banik, Michelle D'Souza, Marie Scandone | ||
| 17 | ChemDB: A public database of small molecules and related chemoinformatics resources Jonathan H. Chen, Erik Linstead, S. Joshua Swamidass, Dennis Wang, Yimeng Dou, Pierre Baldi | ||
| 48 | Implementation of scientific "blogging" into chemical laboratory research Albert C. Fahrenbach, Amar H Flood | ||
| 68 | Surface interaction property based similarity searching with the eHiTS Filter Darryl Reid, Zsolt Zsoldos, Bashir Sadjad, Aniko Simon | ||
| 73 | Using text mining software to identify drug, compound, and disease relationships in the literature Darryl A. León | ||
| 41 | Method for calculating the pKa values of small and large molecules Jozsef Szegezdi, Ferenc Csizmadia | ||
| 42 | NCL-3D: A 3-D natural compound library for computer-aided anticancer drug discovery Zengjian Hu, William M. Southerland | ||
| 43 | Classification of proteomics data by kernel methods Kailin Tang, Tonghua Li | ||
| 44 | Fabrication of chemical and engineering devices KM. Choi | ||
| 45 | Gas chromatography determining 2-methylnaphthalene and 2-methylnaphthoquinone-1,4 in electrosynthesis reaction solution Chengying Song, Liu Zhisheng, Wang Liucheng, Zhao Jianhong, Zhao Mingxing | ||
| 46 | Loop fitting with a combined force field and shape potential Brian P. Kelley, Geoffrey Skillman, Matthew Stahl, Stanislaw Wlodek, Anthony Nicholls | ||
| 47 | Optimization of LC/APCI-MS quinone isomer separation Aidee Gonzalez, Krishna L. Foster, Grady Hanrahan | ||
| 35 | Creation of an instructional module for small college science librarians highlighting free chemistry resources and their use in undergraduate instruction Susan K. Cardinal, Carrie L. Newsom | ||
| 81 | Something old, something new: Creating an undergraduate chemical information seminar Teri M. Vogel, Barbara A. Sawrey | ||
Symposium Grid -- Division of Chemical Information -- Session Listing
The 233rd ACS National Meeting, Chicago, IL, March 25-29, 2007