Biosynthetic consequences of multiple sequential post-transition-state bifurcations

Formation of the Unusual Semivolatile Diterpene Rhizathalene by the Arabidopsis Class I Terpene Synthase TPS08 in the Root Stele Is Involved in Defense against Belowground Herbivory

(2013) M. M. Vaughan et al.   PLANT CELL

Gas-Phase Chemical Dynamics Simulations on the Bifurcating Pathway of the Pimaradienyl Cation Rearrangement: Role of Enzymatic Steering in Abietic Acid Biosynthesis

(2012) Matthew R. Siebert et al.   Journal of Chemical Theory and Computation

Analogies between Synthetic and Biosynthetic Reactions in Which [1,2]-Alkyl Shifts Are Combined with Other Events: Dyotropic, Schmidt, and Carbocation Rearrangements

(2012) Osvaldo Gutierrez et al.   JOURNAL OF ORGANIC CHEMISTRY

Modular Pathway Engineering of Diterpenoid Synthases and the Mevalonic Acid Pathway for Miltiradiene Production

(2012) Yongjin J. Zhou et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Dynamic Origin of the Stereoselectivity of a Nucleophilic Substitution Reaction

(2012) Xavier S. Bogle et al.   ORGANIC LETTERS

Dynamics, transition states, and timing of bond formation in Diels-Alder reactions

(2012) K. Black et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Direct chemical dynamics simulations: coupling of classical and quasiclassical trajectories with electronic structure theory

(2012) Manikandan Paranjothy et al.   Wiley Interdisciplinary Reviews-Computational Molecular Science

Electrostatic effects on (di)terpene synthase product outcome

(2011) Ke Zhou et al.   CHEMICAL COMMUNICATIONS

The Need for Enzymatic Steering in Abietic Acid Biosynthesis: Gas-Phase Chemical Dynamics Simulations of Carbocation Rearrangements on a Bifurcating Potential Energy Surface

(2011) Matthew R. Siebert et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

On the Mechanism and Selectivity of the Combined C−H Activation/Cope Rearrangement

(2011) Jørn H. Hansen et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Biosynthesis via carbocations: Theoretical studies on terpene formation

(2011) Dean J. Tantillo   NATURAL PRODUCT REPORTS

Sesquiterpene synthases: Passive catalysts or active players?

(2011) David J. Miller et al.   NATURAL PRODUCT REPORTS

Do we fully understand what controls chemical selectivity?

(2011) Julia Rehbein et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Insights from the great 2011 Japan earthquake

(2011) Thorne Lay et al.   PHYSICS TODAY

The carbocation continuum in terpene biosynthesis—where are the secondary cations?

(2010) Dean J. Tantillo   CHEMICAL SOCIETY REVIEWS

Theory, Experiment and Unusual Features of Potential Energy Surfaces of Pericyclic and Pseudopericyclic Reactions with Sequential Transition Structures

(2010) David Martin Birney   CURRENT ORGANIC CHEMISTRY

Alkene Hydroboration: Hot Intermediates That React While They Are Cooling

(2010) David R. Glowacki et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Recrossing and Dynamic Matching Effects on Selectivity in a Diels-Alder Reaction

(2009) Zhihong Wang et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

The Energy Landscape of 3-Deoxy-d-manno-octulosonate 8-Phosphate Synthase

(2009) Peng Tao et al.   BIOCHEMISTRY

Phase Space Prediction of Product Branching Ratios: Canonical Competitive Nonstatistical Model

(2009) Jingjing Zheng et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Multidimensional Exploration of Valley−Ridge Inflection Points on Potential-Energy Surfaces

(2009) April N. Sheppard et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Newtonian Kinetic Isotope Effects. Observation, Prediction, and Origin of Heavy-Atom Dynamic Isotope Effects

(2009) Kelmara K. Kelly et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A potential energy surface bifurcation in terpene biosynthesis

(2009) Young J. Hong et al.   Nature Chemistry

A Functional Genomics Approach to Tanshinone Biosynthesis Provides Stereochemical Insights

(2009) Wei Gao et al.   ORGANIC LETTERS

Bifurcations on Potential Energy Surfaces of Organic Reactions

(2008) Daniel H. Ess et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Control Elements in Dynamically Determined Selectivity on a Bifurcating Surface

(2008) Jacqueline B. Thomas et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY