Wikidata

(Q29396026)

English

QM/MM Free-Energy Perturbation Compared to Thermodynamic Integration and Umbrella Sampling:  Application to an Enzymatic Reaction

scientific article (publication date: March 2006)

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title
QM/MM Free-Energy Perturbation Compared to Thermodynamic Integration and Umbrella Sampling:  Application to an Enzymatic Reaction (English)
1 reference
stated in
DOI.org query endpoint
reference URL
https://doi.org/10.1021%2FCT050252W
retrieved
14 April 2017
author
Walter Thiel
series ordinal
5
object named as
Walter Thiel
0 references
Johannes Kästner
object named as
Johannes Kästner
series ordinal
1
0 references

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