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KDMC11
Knowledge Discovery and Management in Chemoinformatics |
A word cloud on the descritption of this course:
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| Course Timetable |
| KDMC11 | Knowledge Discovery and Management in Chemoinformatics |
| Tue, July 12th |
Day #1
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| 09:30 - 11:00 | Chemical information presentation and retrieval in electronic form |
| 11:00 - 11:30 | Coffee Break |
| 11:30 - 12:30 | Public and commercially available chemical databases and search engines |
| 12:30 - 14:00 | Lunch Break |
| 14:00 - 16:00 | PubChem, ChEMBL, DrugBank |
| 16:00 - 16:30 | Tea Break |
| 16:30 - 18:00 | CSLS, CWM, OSRA |
| Wed, July 13th |
Day #2
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| 09:30 - 11:00 | Chemical structure descriptors for (Q)SAR/(Q)SPR studies |
| 11:00 - 11:30 | Coffee Break |
| 11:30 - 12:30 | Chemical similarity search: benefits and drawbacks |
| 12:30 - 14:00 | Lunch Break |
| 14:00 - 16:00 | E-DRAGON, Open BABEL |
| 16:00 - 16:30 | Tea Break |
| 16:30 - 18:00 | UCI Chemical Search, ChemSpider, ChemNavigator |
| Thu, July 14th |
Day #3
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| 09:30 - 11:00 | Identification and validation of pharmacological targets |
| 11:00 - 11:30 | Coffee Break |
| 11:30 - 12:30 | Prediction of biological activity spectra for chemical substances |
| 12:30 - 14:00 | Lunch Break |
| 14:00 - 16:00 | SciClips, TTD, HIT |
| 16:00 - 16:30 | Tea Break |
| 16:30 - 18:00 | PASS, PharmaExpert |
| Fri, July 15th |
Day #4
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| 09:30 - 11:00 | (Q)SAR and (Q)SPR models creation and validation |
| 11:00 - 11:30 | Coffee Break |
| 11:30 - 12:30 | (Q)SAR and (Q)SPR models application in finding and optimization of leads |
| 12:30 - 14:00 | Lunch Break |
| 14:00 - 16:00 | ChemBench, GUSAR, OpenTox |
| 16:00 - 16:30 | Tea Break |
| 16:30 - 18:00 | Final Discussion / Course Wrap-up |
| Course Homepage |
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Instituto Gulbenkian de Ciência, Apartado 14, 2781-901 Oeiras, Portugal Last updated: February 28th 2011 |