Finding reaction mechanisms, intuitive or otherwise.

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Mechanistic Investigations of the Iron(III)-Catalyzed Carbonyl-Olefin Metathesis Reaction.Automated Quantum Mechanical Predictions of Enantioselectivity in a Rhodium-Catalyzed Asymmetric Hydrogenation.

P2860

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P2860

Finding reaction mechanisms, intuitive or otherwise.

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http://www.wikidata.org/entity/Q48165166

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2016 nî lūn-bûn

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2016年の論文

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2016年学术文章

@wuu

2016年学术文章

@zh-cn

2016年学术文章

@zh-hans

2016年学术文章

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2016年学术文章

@zh-sg

2016年學術文章

@yue

2016年學術文章

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2016年學術文章

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name

Finding reaction mechanisms, intuitive or otherwise.

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Finding reaction mechanisms, intuitive or otherwise.

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type

Item

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Finding reaction mechanisms, intuitive or otherwise.

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Finding reaction mechanisms, intuitive or otherwise.

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Finding reaction mechanisms, intuitive or otherwise.

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Finding reaction mechanisms, intuitive or otherwise.

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P1476

Finding reaction mechanisms, intuitive or otherwise.

@en

P2093

Paul M Zimmerman

http://www.w3.org/2001/XMLSchema#string

P2860

Platinum catalysts for the high-yield oxidation of methane to a methanol derivative

Stabilization and structure calculations for noncovalent interactions in extended molecular systems based on wave function and density functional theories.

Escaping free-energy minima.

Quantum mechanical modeling of catalytic processes.

Computation and Experiment: A Powerful Combination to Understand and Predict Reactivities.

Experimental and Computational Assessment of Reactivity and Mechanism in C(sp(3))-N Bond-Forming Reductive Elimination from Palladium(IV).

Reliable Transition State Searches Integrated with the Growing String Method.

Growing string method with interpolation and optimization in internal coordinates: method and examples.

Automated discovery of chemically reasonable elementary reaction steps.

Theory and Modeling of Asymmetric Catalytic Reactions.

P304

501-504

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P31

scholarly article

P356

10.1039/C6OB02183B

http://www.w3.org/2001/XMLSchema#string

P433

http://www.w3.org/2001/XMLSchema#string

P478

http://www.w3.org/2001/XMLSchema#string

P50

Amanda L Dewyer

P577

2016-12-12T00:00:00Z

http://www.w3.org/2001/XMLSchema#dateTime

P698

27942662

http://www.w3.org/2001/XMLSchema#string

Finding reaction mechanisms, intuitive or otherwise.

about

P2860

P2860

Finding reaction mechanisms, intuitive or otherwise.

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P1476

P2093

P2860

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P31

P356

P433

P478

P50

P577

P698

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P1476

P2093

P2860

P304

P31

P356

P433

P478

P50

P577

P698