(5) Empirically fitted force fields, commonly used in biochemistry, can describe conformational changes and the dynamics of organic molecules in the absence of chemical reactions. However, the ...

Marked conformational rearrangements of C3 and factor B are central to their biological functions. The structure of complement protein C3 reveals a large, modular protein consisting of 13 domains ...

A comparison of computation time between Glide and our algorithm is shown in Table S1. The calculation time for our algorithm is longer than the calculation time for Glide because our algorithm was ...

Nearly a century of innovation and vision: that’s what it takes to be the University of Oklahoma. And it’s what makes the University of Oklahoma's Michael F. Price College of Business #1 in Oklahoma, ...