Laboratory of Structural Quantitative Biology

NIH/NIEHS (National Institute of Environmetal Health Sciences)

Address: North Carolina

Subjects of collaboration

Publications

1. K. Kholmurodov, W. Smith, K. Yasuoka, and T. Ebisuzaki, A Highly Vectorised "Link-Cell" FORTRAN Code for the DL_POLY Molecular Dynamics Simulation Package, Computer Physics Communications, (2000), 125, 167-192.
2. K.Kholmurodov, W.Smith, K.Yasuoka, and T.Ebisuzaki. Some Optimisations of DL_POLY Molecular Dynamics Simulation Code on the Fujitsu VPP700. Proc. High Performance Comput. and Appl., Published by JSPC, Tokyo, Japan, 2000.
3. Kholmurodov, K., Smith, W., Yasuoka, K., Darden, T., and Ebisuzaki, T. A smooth-particle mesh Ewald method for DL_POLY molecular dynamics simulation package on the Fujitsu VPP700. Journal of Computational Chemistry, 21 (13): 1187-1191 , 2000.
4. CFPP - HOKKE'2000 (IPSJ SIGHPC&SIGARC), March 2000, Hokkaido, Japan
5. The Fifteenth International Conference on Nucleation and Atmospheric Aerosols, University of Missouri-Rolla, 6-11 August 2000.