Global optimization and finite temperature simulations of atomic clusters: Use of XenArm clusters as test systems

Global Optimization by Basin-Hopping and the Lowest Energy Structures of Lennard-Jones Clusters Containing up to 110 Atoms

The Journal of Physical Chemistry A · 1997 · 3K citations · Full text

Natural Sciences, Chemistry, Physics +16

Funnels, pathways, and the energy landscape of protein folding: A synthesis

Joseph D. Bryngelson, José N. Onuchic, Nicholas D. Socci et al. · Proteins Structure Function and Bioinformatics · 1995 · 2.7K citations

Life Sciences, Biochemistry, Biophysics +17

New Monte Carlo technique for studying phase transitions

Alan M. Ferrenberg, Robert H. Swendsen · Physical Review Letters · 1988 · 2.7K citations

Natural Sciences, Physics, Computational Physics +16

Optimized Monte Carlo data analysis

Alan M. Ferrenberg, Robert H. Swendsen · Physical Review Letters · 1989 · 2.6K citations

Computing, Computer Science, Statistical Computing +4

Reversible work transition state theory: application to dissociative adsorption of hydrogen

Gregory Mills, Hannes Jónsson, Gregory K. Schenter · Surface Science · 1995 · 2.3K citations · Full text

Natural Sciences, Chemistry, Physics +14