[scholarship] [international-scholarship] [International Scholarship] Holland: Ph.D. Student Computational Organic Chemistry
- From: "A. Fatih Syuhud" <fatihsyuhud@xxxxxxxxx>
- To: international-scholarship@xxxxxxxxxxxxxxx
- Date: Sat, 11 Nov 2006 10:50:28 -0800 (PST)
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Category: Scholarship Netherlands Ph.D. Student/job vacancy in Computational
Organic Chemistry
The project aims to address long-standing mechanistic disparities of the
catalytic cycles (i.e., electron transfer; binding, transport, and
activationof molecular oxygen; and the actual catalytic reactions) using
state of the art theoretical methods. The combination of high level ab
initioand DFT methods in combination with fast force field techniques
(QM/MM)will be used to analyze the subtleties that influence and distinguish
the complexity of electronic states of the heme reactive intermediates in
relation to the diversity of reaction channels in which they participate.
The focus is particularly on the second sphere interactions (H-bonding,
localpH) and the proximal residue of the prosthetic group that control the
activity of Compound 0, I and II. By QM/MM modeling and analyzing the
H-bonding network (i.e. using the ADF partition scheme ) of MD-selected
conformations, the PhD student will establish mechanisms that activates the
intermediates and directs their reaction channels, but also how these
mechanistic pathways maybe manipulated.
Requirements
We are looking for a highly motivated and enthusiastic researcher with
experience in computational chemistryand an MSc in an appropriate field.
Information
Further information can be obtained from
Prof. Dr. K. Lammertsma (K.Lammertsma@xxxxxxxxx,
Phone: +31 20 59 87480) or Dr. A. W. Ehlers
(AW.Ehlers@xxxxxxxxx, +31 20 598 7518).
A detailed description of the position can be found on our web site[1]:
Applications, including a motivation for carrying out this PhD project and a
curriculum vitae can be submitted to
Prof. Dr. K. Lammertsma or Dr A. W Ehlers,
Faculty of Sciences, Division Chemistry, Vrije
Universit eit, De Boelelaan 1083, 1081 HV Amsterdam.
Application deadline: open until filled.
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Posted by A. Fatih Syuhud to International Scholarship[9] at 11/12/2006
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Situs Lowongan kerja dan Beasiswa - Free Job Vacancy and Scholarship Info
1. Job Vacancy Indonesia
http://karirkerja.blogspot.com
2. Situs Info Lowongan Kerja Indonesia
http://infokerjas.blogpsot.com
3. Free Scholarship info for international students
http://scholarshipz.blogpsot.com
4. Scholarship info for Indonesian and international students
http://informasi-beasiswa.blogspot.com
5. Informasi Beasiswa Indonesia dalam negeri dan luar negeri
http://beasiswas.blogspot.com
6. Cara Membuat blog - Tutorial blog
http://kolom-mario.blogspot.com
=======================================
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