Subdivision approach to target-constrained conformational searching.
Conformational searching is common in many applications and algorithmic improvements on either speed or the quality would have a profound impact. In this paper, we address a target-constrained conformational searching problem and show two subdivision methods approximating the solutions rather than solving for the exact solutions. The performance of the methods is presented.
Zhang
Ming
M
Departments of Biostatistics and Applied Mathematics, The University of Texas M.D. Anderson Cancer Center Houston TX 77030 USA. (mzhang@mdanderson.org).
Wang
Liqun
L
Maxwell
David
D