Sampling the Energetics of the Hydride-Ion Transfer Step in Catalysis of Dihydrofolate Reductase by the ONIOM QM/MM Hybrid Method

Ivan Rostov, Peter Cummins, Thom Vreven, Rika Kobayashi, Anne Frisch, Jill Gready

Research output: Contribution to journal › Meeting Abstract › peer-review

Original language	English
Pages (from-to)	1
Journal	Modelling Structure and Reactivity
Publication status	Published - 2005
Event	World Association of Theoretically Oriented Chemists Congress 2005 - Cape Town South Africa Duration: 1 Jan 2005 → …

Cite this

@article{14db658c33244edcb16e3aa61ce96156,

title = "Sampling the Energetics of the Hydride-Ion Transfer Step in Catalysis of Dihydrofolate Reductase by the ONIOM QM/MM Hybrid Method",

author = "Ivan Rostov and Peter Cummins and Thom Vreven and Rika Kobayashi and Anne Frisch and Jill Gready",

year = "2005",

language = "English",

pages = "1",

journal = "Modelling Structure and Reactivity",

publisher = "University of Stellenbosch",

note = "World Association of Theoretically Oriented Chemists Congress 2005 ; Conference date: 01-01-2005",

}

TY - JOUR

T1 - Sampling the Energetics of the Hydride-Ion Transfer Step in Catalysis of Dihydrofolate Reductase by the ONIOM QM/MM Hybrid Method

AU - Rostov, Ivan

AU - Cummins, Peter

AU - Vreven, Thom

AU - Kobayashi, Rika

AU - Frisch, Anne

AU - Gready, Jill

PY - 2005

Y1 - 2005

M3 - Meeting Abstract

SP - 1

JO - Modelling Structure and Reactivity

JF - Modelling Structure and Reactivity

T2 - World Association of Theoretically Oriented Chemists Congress 2005

Y2 - 1 January 2005

ER -