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I

Ivan S. Ufimtsev

Stanford University

18H指数
32论文数
4.7K被引数
收录论文 15
发表时间
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TeraChem: A graphical processing unit-acceleratedelectronic structure package forlarge-scaleab initio molecular dynamics
errWILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE
IF27
err2020-07-26
err223
errOAAI
errSeritan, Stefan; Bannwarth, Christoph; Fales, Bryan S.; Hohenstein, Edward G.; Isborn, Christine M.; Kokkila-Schumacher, Sara I. L.; Li, Xin; Liu, Fang; Luehr, Nathan; Snyder, James W., Jr.; Song, Chenchen; Titov, Alexey, V; Ufimtsev, Ivan S.; Wang, Lee-Ping; Martinez, Todd J.
err分享
err收藏
TeraChem: Accelerating electronic structure and ab initio molecular dynamics with graphical processing units
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-06-12
err113
errOAAI
errSeritan, Stefan; Bannwarth, Christoph; Fales, B. Scott; Hohenstein, Edward G.; Kokkila-Schumacher, Sara I. L.; Luehr, Nathan; Snyder, James W., Jr.; Song, Chenchen; Titov, Alexey, V; Ufimtsev, Ivan S.; Martinez, Todd J.
err分享
err收藏
Structural insights into the aPKC regulatory switch mechanism of the human cell polarity protein lethal giant larvae 2
errPROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
IF9.1
err2019-05-14
err15
errOAAI
errAlmagor, Lior; Ufimtsev, Ivan S.; Ayer, Aruna; Li, Jingzhi; Weis, William I.
err分享
err收藏
Unsupervised determination of protein crystal structures蛋白质晶体结构的无监督测定
errPROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
IF9.1
err2019-05-14
err3
errOAAI
errUfimtsev, Ivan S.; Levitt, Michael
err分享
err收藏
Solving the structure of Lgl2, a difficult blind test of unsupervised structure determination
errPROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
IF9.1
err2019-05-14
err5
errOAAI
errUfimtsev, Ivan S.; Almagor, Lior; Weis, William I.; Levitt, Michael
err分享
err收藏
Analytic first derivatives of floating occupation molecular orbital-complete active space configuration interaction on graphical processing units
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2015-07-06
err51
PREAI
errHohenstein, Edward G.; Bouduban, Marine E. F.; Song, Chenchen; Luehr, Nathan; Ufimtsev, Ivan S.; Martinez, Todd J.
err分享
err收藏
An atomic orbital-based formulation of the complete active space self-consistent field method on graphical processing units
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2015-06-08
err118
PREAI
errHohenstein, Edward G.; Luehr, Nathan; Ufimtsev, Ivan S.; Martinez, Todd J.
err分享
err收藏
Generating Efficient Quantum Chemistry Codes for Novel Architectures
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2012-11-12
err348
PREAI
errTitov, Alexey V.; Ufimtsev, Ivan S.; Luehr, Nathan; Martinez, Todd J.
err分享
err收藏
Excited-State Electronic Structure with Configuration Interaction Singles and Tamm-Dancoff Time-Dependent Density Functional Theory on Graphical Processing Units
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2011-05-23
err213
errOAAI
errIsborn, Christine M.; Luehr, Nathan; Ufimtsev, Ivan S.; Martinez, Todd J.
err分享
err收藏
Dynamic Precision for Electron Repulsion Integral Evaluation on Graphical Processing Units (GPUs)
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2011-03-23
err154
PREAI
errLuehr, Nathan; Ufimtsev, Ivan S.; Martinez, Todd J.
err分享
err收藏
Quantum Chemistry on Graphical Processing Units. 2. Direct Self-Consistent-Field (SCF) Implementation (vol 5, pg 1004, 2009)
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2009-10-27
err24
PREAI
errUfimtsev, Ivan S.; Martinez, Todd J.
err分享
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Observation of a Zundel-like transition state during proton transfer in aqueous hydroxide solutions
errPROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
IF9.1
err2009-09-08
err120
errOAAI
errRoberts, Sean T.; Petersen, Poul B.; Ramasesha, Krupa; Tokmakoff, Andrei; Ufimtsev, Ivan S.; Martinez, Todd J.
err分享
err收藏
Quantum Chemistry on Graphical Processing Units. 3. Analytical Energy Gradients, Geometry Optimization, and First Principles Molecular Dynamics
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2009-08-25
err830
PREAI
errUfimtsev, Ivan S.; Martinez, Todd J.
err分享
err收藏
Quantum Chemistry on Graphical Processing Units. 2. Direct Self-Consistent-Field Implementation
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2009-03-06
err403
errOAAI
errUfimtsev, Ivan S.; Martinez, Todd J.
err分享
err收藏
Quantum chemistry on graphical processing units.: 1.: Strategies for two-electron integral evaluation
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2008-01-25
err525
PREAI
errUfimtsev, Ivan S.; Martinez, Todd J.
err分享
err收藏

研究方向

暂时未获取到该数据
合作学者
合作期刊
W
William I. Weis
H 指数: 95 · 论文数: 385
T
Todd J. Martı́nez
H 指数: 93 · 论文数: 666
M
Michael Levitt
H 指数: 88 · 论文数: 298
A
Andrei Tokmakoff
H 指数: 76 · 论文数: 344
李鑫 封面图
李鑫 (Xin Li)
H 指数: 72 · 论文数: 661
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