Zobrazeno 1 - 10
of 90
pro vyhledávání: '"Atlas Susan R"'
Autor:
Atlas, Susan R.
Quantum-mechanically-driven charge polarization and charge transfer are ubiquitous in biomolecular systems, controlling reaction rates, allosteric interactions, ligand-protein binding, membrane transport, and dynamically-driven structural transformat
Externí odkaz:
http://arxiv.org/abs/2101.04786
We evaluate the second-generation Intel Xeon Phi coprocessor based on the Intel Many Integrated Core (MIC) architecture, aka the Knights Landing or KNL, for simulating neutrino oscillations in (core-collapse) supernovae. For this purpose we have deve
Externí odkaz:
http://arxiv.org/abs/1912.10596
We have developed the astrophysical simulation code XFLAT to study neutrino oscillations in supernovae. XFLAT is designed to utilize multiple levels of parallelism through MPI, OpenMP, and SIMD instructions (vectorization). It can run on both CPU and
Externí odkaz:
http://arxiv.org/abs/1510.02163
We present a new interatomic potential for water captured in a charge-transfer embedded atom method (EAM) framework. The potential accounts for explicit, dynamical charge transfer in atoms as a function of the local chemical environment. As an initia
Externí odkaz:
http://arxiv.org/abs/0705.0857
Linear discrimination, from the point of view of numerical linear algebra, can be treated as solving an ill-posed system of linear equations. In order to generate a solution that is robust in the presence of noise, these problems require regularizati
Externí odkaz:
http://arxiv.org/abs/q-bio/0601002
Autor:
Valone, Steven M., Atlas, Susan R.
Publikováno v:
Phys. Rev. Lett. 97, 256402 (2006)
The energies of a pair of strongly-interacting subsystems with arbitrary noninteger charges are examined from closed and open system perspectives. An ensemble representation of the charge dependence is derived, valid at all interaction strengths. Tra
Externí odkaz:
http://arxiv.org/abs/cond-mat/0601009
Autor:
Valone, Steven M., Atlas, Susan R.
The empirical valence bond (EVB) method [J. Chem. Phys. 52, 1262 (1970)] has always embodied charge transfer processes. The mechanism of that behavior is examined here and recast for use as a new empirical potential energy surface for large-scale sim
Externí odkaz:
http://arxiv.org/abs/physics/0311099
Autor:
Urtishak, Karen A., Edwards, Alena Y.Z., Wang, Li-San, Hudome, Amanda, Robinson, Blaine W., Barrett, Jeffrey S., Cao, Kajia, Cory, Lori, Moore, Jonni S., Bantly, Andrew D., Yu, Qian-Chun, Chen, I-Ming L., Atlas, Susan R., Willman, Cheryl L., Kundu, Mondira, Carroll, Andrew J., Heerema, Nyla A., Devidas, Meenakshi, Hilden, Joanne M., Dreyer, ZoAnn E., Hunger, Stephen P., Reaman, Gregory H., Felix, Carolyn A. *
Publikováno v:
In Blood 4 April 2013 121(14):2689-2703
Autor:
Kang, Huining, Wilson, Carla S., Harvey, Richard C., Chen, I.-Ming, Murphy, Maurice H., Atlas, Susan R., Bedrick, Edward J., Devidas, Meenakshi, Carroll, Andrew J., Robinson, Blaine W., Stam, Ronald W., Valsecchi, Maria G., Pieters, Rob, Heerema, Nyla A., Hilden, Joanne M., Felix, Carolyn A., Reaman, Gregory H., Camitta, Bruce, Winick, Naomi, Carroll, William L., Dreyer, ZoAnn E., Hunger, Stephen P., Willman, Cheryl L. *
Publikováno v:
In Blood 23 February 2012 119(8):1872-1881
Autor:
Mullighan, Charles G., Zhang, Jinghui, Harvey, Richard C., Collins-Underwood, J. Racquel, Schulman, Brenda A., Phillips, Letha A., Tasian, Sarah K., Loh, Mignon L., Su, Xiaoping, Liu, Wei, Devidas, Meenakshi, Atlas, Susan R., Chen, I-Ming, Clifford, Robert J., Gerhard, Daniela S., Carroll, William L., Reaman, Gregory H., Smith, Malcolm, Downing, James R., Hunger, Stephen P., Willman, Cheryl L., Rowley, Janet D.
Publikováno v:
Proceedings of the National Academy of Sciences of the United States of America, 2009 Jun 01. 106(23), 9414-9418.
Externí odkaz:
https://www.jstor.org/stable/40483229