Concepedia

Shane O. Samuelson

SO

Statistics

Publications

5

Citations

349

H-Index

5

Active since

1997

Affiliations

Indiana University Bloomington(Current)

Courant Institute of Mathematical Sciences

New York University

Shane O. Samuelson is an author at Indiana University Bloomington specializing in computational chemistry, molecular dynamics, and natural sciences.

Publications per year

1997–2002

5

Publications

5

Exploiting multiple levels of parallelism in Molecular Dynamics based calculations via modern techniques and software paradigms on distributed memory computers

Mark E. Tuckerman, Dawn A. Yarne, Shane O. Samuelson et al. · Computer Physics Communications · 2000 · 207 citations

, , +16

Using Novel Variable Transformations to Enhance Conformational Sampling in Molecular Dynamics

Zhongwei Zhu, Mark E. Tuckerman, Shane O. Samuelson et al. · Physical Review Letters · 2002 · 56 citations

, , +15

Computer Simulation Studies of Finite Temperature Conformational Equilibrium in Alanine-Based Peptides

Shane O. Samuelson, Glenn Martyna · The Journal of Physical Chemistry B · 1999 · 34 citations

, , +17

Two dimensional umbrella sampling techniques for the computer simulation study of helical peptides at thermal equilibrium: The 3K(I) peptide <i>in vacuo</i> and solution

Shane O. Samuelson, Glenn Martyna · The Journal of Chemical Physics · 1998 · 29 citations

, , +17

Modern Computational Methodology Applied to the Simulation of Blocked Trialanine Peptide <i>in Vacuo</i>, Water Clusters, and Bulk Water

Shane O. Samuelson, Douglas J. Tobias, Glenn Martyna · The Journal of Physical Chemistry B · 1997 · 23 citations

, , +17

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