Adaptive umbrella sampling of the potential energy: modified updating procedure of the umbrella potential and application to peptide folding

Christian Bartels, Michael Schaefer, Martin Karplus

DOI: 10.1007/s002140050407

Theoretical Chemistry Accounts

Data up to Jan 2025

Published1999

Citations16

References2

Fields

Chemistry Physics Mathematics Engineering Chemical physics Statistical physics Computational chemistry

Total Citations Per Year

Abstract

References (2)

Dynamics of Proteins and Nucleic Acids

1988 • 1,274 citations

Proteins: A Theoretical Perspective of Dynamics, Structure and Thermodynamics

1990 • 758 citations

Cited By (0)

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Adaptive umbrella sampling of the potential energy: modified updating procedure of the… (1999) – Theoretical Chemistry Accounts | Metascience Observatory Explorer