Yuk Y. Sham

Consistent Calculations of p<i>K</i>_a's of Ionizable Residues in Proteins:  Semi-microscopic and Microscopic Approaches

Yuk Y. Sham, Zhen T. Chu, Arieh Warshel · The Journal of Physical Chemistry B · 1997 · 362 citations

Natural Sciences, Biochemistry, Biophysics +17

Blue Gene: A vision for protein science using a petaflop supercomputer

Frances Allen, George Almási, Wanda Andreoni et al. · IBM Systems Journal · 2001 · 256 citations

Life Sciences, High-performance Computing, Biomolecular Modeling +10

Examining methods for calculations of binding free energies: LRA, LIE, PDLD-LRA, and PDLD/S-LRA calculations of ligands binding to an HIV protease

Yuk Y. Sham, Zhen T. Chu, H. Tao et al. · Proteins Structure Function and Bioinformatics · 2000 · 218 citations

Natural Sciences, Biophysics, Biomolecular Modeling +16

The Effect of Protein Relaxation on Charge-Charge Interactions and Dielectric Constants of Proteins

Yuk Y. Sham, Ingo Muegge, Arieh Warshel · Biophysical Journal · 1998 · 197 citations · Full text

Natural Sciences, Biochemistry, Biophysics +16

How important are entropic contributions to enzyme catalysis?

Marek Štrajbl, Timothy M. Glennon, Yuk Y. Sham et al. · Proceedings of the National Academy of Sciences · 2000 · 187 citations

Life Sciences, Biochemistry, Chemistry +17