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北京石油化工学院2026年研究生招生接收调剂公告
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武大

木虫 (著名写手)

[交流] 【原创】JPCB上院士愤怒了

On Unjustifiably Misrepresenting the EVB Approach While Simultaneously Adopt
ing It

J. Phys. Chem. B, 2009, 113 (31), pp 10905–10915

http://pubs.acs.org/doi/pdfplus/10.1021/jp901709f
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武大

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中国社会这样的事可能就没有了!
10楼2009-08-27 12:00:58
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xgyanger

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ABSTRACT: In recent years, the EVB has become a widely used tool in the QM/MM modeling of reactions in condensed phases and in biological systems, with ever increasing popularity. However, despite the fact that its power and validity have been repeatedly established since 1980, a recent work (Valero, R.; et al. J. Chem. Theory Comput. 2009, 5, 1) has strongly criticized this approach, while not discussing the fact that one of the authors is effectively using it himself for both gas-phase and solution studies. Here, we have responded to the most serious unjustified assertions of that paper, covering both the more problematic aspects of that work and the more complex scientific aspects. Additionally, we have demonstrated that the poor EVB results shown in Valero et al. which where presented as verification of the unreliability of the EVB model were in fact obtained by the use of incorrect parameters, without comparing to the correct surface obtained by our program.
一篇paper引发的血案?
4楼2009-08-26 15:30:36
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kovacs

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~~——××


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引用回帖:
Originally posted by xgyanger at 2009-8-26 15:30:
ABSTRACT: In recent years, the EVB has become a widely used tool in the QM/MM modeling of reactions in condensed phases and in biological systems, with ever increasing popularity. However, despite  ...

真理面前无权威,学术领域才有所谓的“权威”。
真理面前,院士也不一定work
过好每一天是最重要的
5楼2009-08-26 15:56:27
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luyaozju

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引用回帖:
Originally posted by yangliu29 at 2009-8-26 16:02:
院士很吓人吗?

似乎是美国的院士 要值钱一些的
7楼2009-08-26 16:43:48
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