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Hybrid Potentials for the Simulation of Phosphoryl Transfer Reactions

HYBRID POTENTIALS FOR THE SIMULATION OF PHOSPHORYL TRANSFER REACTIONS [Pg.112]

The work of Arantes and Loos involved a modified MNDO Hamiltonian in which the valence orbitals of sulfur and phosphorus were described by s and p orbitals [Pg.112]

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Hybrid potential

Hybrid simulations

Hybridization for

Hybridization reactions

Of 2 -phosphorylated

Phosphoryl transfer

Phosphoryl-transfer reactions phosphorylated

Phosphorylation potential

Phosphorylation reactions

Potentials of transfer

REACTION SIMULATION

The Phosphoryl Transfer Reaction

Transfer simulation

Transferable potential