eindhoven university of technology software and internet tools for continual education in analytical...
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Eindhoven University of Technology
Software and Internet Tools for Continual Education in Analytical Chemistry
Jetse C. Reijenga
You• An asset to a company profile• Contributing to a company's profit• Solving today's (and tomorrow's) problems• And deliver the results……yesterday
Me• associate professor (anal. chem.)• more-or-less basic research• solving largely academic problems• now mainly educational activities
Why Continuing Education• 5 years in playing• 10 years of learning• 5 years of studying• 40 years of working• 25 years of retirement
Questions:• Science advances rapidly…..do you?• Is continuing education part of your job?• Ever heard of natural curiosity?• How does an intellectual retire?
Equipment Theory(technique)
Application (=solve problem)
Experience
techniques applications
How much experience do you have?
Use of ICT, what is needed
• Background knowledge• Time (=money…)• Competence (English language skills)• Facilities
• hardware• software• internet connection
What can ICT offer:
• Communication• Access
• Data (data bases)• Literature• Simulation software
Communication tools
• use webspace to provide info• use e-mail or group-mail• chat session• discussion-web• Netmeeting• Moodle-group• e-mail lists
Consider application- or technique oriented
Analytical literature on CD-ROM
22899
ACCESS to:
MECC migration index prediction
From: Yasushi Ishihama et al, Anal. Chem. 68(1996) 1028-1032
logP (octanol/water) sources• Experimental values (literature) • Website (http://esc.syrres.com/interkow)
Software:• ACD/logP (ACD/Labs)• CLOGP (BioByte)• KOWWIN (Syracuse)• SciLogP (SciVision)• AccuLogP (Microsimulations)• ProLogP (CompuDrug)
Comparison of two logP estimators
Estimation software for pKa values
title
Different instrument “simulators”
• Interactive demo’s (Netlogo, Wingz, .....)• Separaration Optimizers (ACD, Drylab, .....)• Steady-state Simulators (Gaš, Reijenga, ....)
• detector signal (s vs. t)• Dynamic Simulators (Gaš, Reijenga, ....)
• microscale, local distribution (c vs. x)
Netlogo 2.0
Wingz
ACD
GC and LC
DryLab
title
Peakmaster 5.0
title
Cesar
CESight
title
title
title
title
Database
Virtual lab of anal. separation techniques
ProteinLab
• heat treatment• ammonium Sulphate fractionation• gel filtration• ion exchange chromatography• hydrophobic interaction chromatography• preparative isoelectric focusing• affinity chromatography
1D and 2D PAGE for purity check
title
CZE/ITP
Interesting weblinks.......................
