An empirical valence bond approach for comparing reactions in solutions and in enzymes

Arieh Warshel, R. M. W. (1980). An empirical valence bond approach for comparing reactions in solutions and in enzymes.

Type

Unclassified

Intellectual base

Unclassified

Year

1980

DOI

10.1021/ja00540a008

Link

https://doi.org/10.1021/ja00540a008

Cited by

1 citation across 1 artifact.

Domain-specific

• Empirical valence bond
  • Valence-bond states, diagonal force-field terms, off-diagonal couplings and calibration reactions must be declared; transferability is empirical and environment-dependent.

Verification

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Registry ID ref:65068ccbc179 · see in the full table