☆麦兜☆ » Literature_Archive » perspective of theoretical chemistry on Science magazine

Azide 发表于 2008-8-12 00:17

perspective of theoretical chemistry on Science magazine

I put all these files into one pdf file, Please send me an E-mail to [email]azideanion@gmail.com[/email] if you need a copy. I tried to upload to chem8 and failed. :(

Challenges in Theoretical Chemistry

Theoretical Possibilities
    Julia Fahrenkamp-Uppenbrink, Phil Szuromi, Jake Yeston, and Robert Coontz
    Science 8 August 2008: 783.
    Summary »|   PDF »|   

News

Problem Solved* (*sort of)
    Robert F. Service
    Science 8 August 2008: 784-786.
    Researchers have toiled for decades to understand how floppy chains of amino acids fold into functional proteins. Learning many of those rules has brought them to the verge of being able to make predictions about proteins they haven't even discovered. Full Text »|   PDF »|   

Perspectives

Intermolecular Potentials
    Anthony J. Stone
    Science 8 August 2008: 787-789.
    Abstract »|   Full Text »|   PDF »|   
Quantum Dynamics of Chemical Reactions
    David C. Clary
    Science 8 August 2008: 789-791.
    Abstract »|   Full Text »|   PDF »|   
Insights into Current Limitations of Density Functional Theory
    Aron J. Cohen, Paula Mori-Sánchez, and Weitao Yang
    Science 8 August 2008: 792-794.
    Abstract »|   Full Text »|   PDF »|   
Frontiers in Surface Scattering Simulations
    Geert-Jan Kroes
    Science 8 August 2008: 794-797.
    Abstract »|   Full Text »|   PDF »|   Supporting Online Material »|   
Large-Scale Molecular Dynamics Simulations of Self-Assembling Systems
    Michael L. Klein and Wataru Shinoda
    Science 8 August 2008: 798-800.
    Abstract »|   Full Text »|   PDF »|   
Challenges in Modeling Materials Properties Without Experimental Input
    Emily A. Carter
    Science 8 August 2008: 800-803.
    Abstract »|   Full Text »|   PDF »|

Azide 发表于 2008-8-12 00:23

回复 1# Azide 的帖子

The first part, from page 783 to page 791 :)

Azide 发表于 2008-8-12 00:27

回复 1# Azide 的帖子

The second part, from page 792 to page 803 :)

andrewsun 发表于 2008-8-12 05:42

Soft Matter Highlight

I highlight [i]Large-Scale Molecular Dynamics Simulations of Self-Assembling Systems[/i], one of the serial articles you recommended above. This perspective reviewed the power of coarse grain (CG) and all atomic (AA) models of Molecular Dynamics (MD) in computational chemistry, with particular interest in simulation of self-assembly system with a long relaxing period and large scale of phase domain. All references selected there in are highly representative.

Soft matter is a hot topic, but it won't become a systematic field of study until it can be physically modeled and realized.

tutu2000 发表于 2008-8-14 16:35

学习了，谢谢

lihb734 发表于 2008-11-10 08:16

这是一期好的文章，谢谢。

wang 发表于 2008-11-10 16:15

学习学习

zsun 发表于 2008-11-10 23:27

good

michaelyan 发表于 2008-11-14 15:10

Thanks for the informative session...

rhzhang 发表于 2008-11-17 13:30

学习

ce02wjh 发表于 2008-12-5 20:09

谢谢分享

查看完整版本: perspective of theoretical chemistry on Science magazine