Qiang Cui

Cytowane przez

	Wszystkie	Od 2020
Cytowania	31811	11582
h-indeks	86	40
i10-indeks	265	177

2400

1200

600

1800

199819992000200120022003200420052006200720082009201020112012201320142015201620172018201920202021202220232024202582 98 110 127 162 287 344 397 477 618 664 863 1042 1254 1452 1441 1711 1603 1905 1766 1881 1801 1983 2274 2260 2172 2305 587

Dostęp publiczny

Wyświetl wszystko

175 artykułów

22 artykuły

dostępne

niedostępne

Objęte finansowaniem

Współautorzy

Arun YethirajUniversity of WisconsinZweryfikowany adres z wisc.edu
Michael GausPowerCo SEZweryfikowany adres z powerco.de
Demian RiccardiThermodynamic Research Center, NISTZweryfikowany adres z nist.gov
Haibo YuSchool of Chemistry and Molecular Bioscience, University of Wollongong, AustraliaZweryfikowany adres z uow.edu.au
Xiya LuUniversity of Wisconsin MadisonZweryfikowany adres z wisc.edu
Djamaladdin MusaevDirector, Emerson Center, Emory UniversityZweryfikowany adres z emory.edu
Liang MaAssistant Professor of Finance, University of South CarolinaZweryfikowany adres z moore.sc.edu
Robert J. HamersSteenbock Professor of Physical Science and Distinguished Professor, University of WisconsinZweryfikowany adres z wisc.edu
Jejoong YooSungkyunkwan University, Department of PhysicsZweryfikowany adres z skku.edu
Puja GoyalState University of New York at BinghamtonZweryfikowany adres z binghamton.edu
Thomas FrauenheimProfessor für Computational Materials ScienceZweryfikowany adres z bccms.uni-bremen.de
Daniel RostonSouthwestern CollegeZweryfikowany adres z swccd.edu
Nita SahaiUniversity of AkronZweryfikowany adres z uakron.edu
Peter H. KoenigCorporate Functions R&D, Procter and GambleZweryfikowany adres z pg.com
Chuan HeThe University of ChicagoZweryfikowany adres z uchicago.edu
George N. Phillips, Jr.BioSciences at Rice UniversityZweryfikowany adres z rice.edu
Hua GuoDistinguished Professor of Chemistry, University of New MexicoZweryfikowany adres z unm.edu
Dongyue LiangGrainger Distinguished Postdoctoral Researcher, University of Illinois at Urbana-ChampaignZweryfikowany adres z illinois.edu
Zhe WuJohnson & Johnson Innovative MedicineZweryfikowany adres z its.jnj.com
Xi ChenLingnan University, Hong KongZweryfikowany adres z ln.edu.hk

Obserwuj

Qiang Cui

Boston University (previously University of Wisconsin, Madison)

Zweryfikowany adres z bu.edu - Strona główna

Biomolecular simulations quantum chemistry theoretical chemistry computational chemistry biophysics


Tytuł Sortuj wg cytatów Sortuj wg roku Sortuj wg tytułu	Cytowane przez Cytowane przez	Rok
CHARMM: the biomolecular simulation program BR Brooks, CL Brooks III, AD Mackerell Jr, L Nilsson, RJ Petrella, B Roux, ... Journal of computational chemistry 30 (10), 1545-1614, 2009	9403	2009
DFTB3: Extension of the self-consistent-charge density-functional tight-binding method (SCC-DFTB) M Gaus, Q Cui, M Elstner Journal of chemical theory and computation 7 (4), 931-948, 2011	1175	2011
Allostery and cooperativity revisited Q Cui, M Karplus Protein science 17 (8), 1295-1307, 2008	758	2008
A QM/MM implementation of the self-consistent charge density functional tight binding (SCC-DFTB) method Q Cui, M Elstner, E Kaxiras, T Frauenheim, M Karplus The Journal of Physical Chemistry B 105 (2), 569-585, 2001	725	2001
Semiempirical Quantum Mechanical Methods for Noncovalent Interactions for Chemical and Biochemical Applications AS Christensen, T Kubar, Q Cui, M Elstner Chemical Reviews 116 (9), 5301-5337, 2016	484	2016
FTO-mediated formation of N⁶-hydroxymethyladenosine and N⁶-formyladenosine in mammalian RNA Y Fu, G Jia, X Pang, RN Wang, X Wang, CJ Li, S Smemo, Q Dai, ... Nature communications 4 (1), 1798, 2013	484	2013
Normal mode analysis: theory and applications to biological and chemical systems Q Cui, I Bahar CRC press, 2005	449	2005
Parameterization of DFTB3/3OB for sulfur and phosphorus for chemical and biological applications M Gaus, X Lu, M Elstner, Q Cui Journal of chemical theory and computation 10 (4), 1518-1537, 2014	376	2014
Development of effective quantum mechanical/molecular mechanical (QM/MM) methods for complex biological processes D Riccardi, P Schaefer, Yang, H Yu, N Ghosh, X Prat-Resina, P König, ... The Journal of Physical Chemistry B 110 (13), 6458-6469, 2006	347	2006
Extension of the self-consistent-charge density-functional tight-binding method: third-order expansion of the density functional theory total energy and introduction of a … Y Yang, H Yu, DM York, Q Cui, M Elstner J. Phys Chem. A 111, 10861-10873, 2007	342	2007
Structural insight into substrate preference for TET-mediated oxidation L Hu, J Lu, J Cheng, Q Rao, Z Li, H Hou, Z Lou, L Zhang, W Li, W Gong, ... Nature 527 (7576), 118-122, 2015	308	2015
A coarse-grained normal mode approach for macromolecules: an efficient implementation and application to Ca2+-ATPase G Li, Q Cui Biophysical Journal 83 (5), 2457-2474, 2002	262	2002
Density functional tight binding: application to organic and biological molecules M Gaus, Q Cui, M Elstner Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (1), 49-61, 2014	224	2014
A new coarse-grained model for water: the importance of electrostatic interactions Z Wu, Q Cui, A Yethiraj The Journal of Physical Chemistry B 114 (32), 10524-10529, 2010	221	2010
pK_a Calculations in Solution and Proteins with QM/MM Free Energy Perturbation Simulations: A Quantitative Test of QM/MM Protocols D Riccardi, P Schaefer, Q Cui The Journal of Physical Chemistry B 109 (37), 17715-17733, 2005	208	2005
Molecular properties from combined QM/MM methods. I. Analytical second derivative and vibrational calculations Q Cui, M Karplus The Journal of Chemical Physics 112 (3), 1133-1149, 2000	197	2000
Hydrogen elimination from a hydroxycyclopentadienyl ruthenium (II) hydride: Study of hydrogen activation in a ligand− metal bifunctional hydrogenation catalyst CP Casey, JB Johnson, SW Singer, Q Cui Journal of the American Chemical Society 127 (9), 3100-3109, 2005	195	2005
A normal mode analysis of structural plasticity in the biomolecular motor F1-ATPase Q Cui, G Li, J Ma, M Karplus Journal of Molecular Biology 340 (2), 345-372, 2004	193	2004
Is a “proton wire” concerted or stepwise? A model study of proton transfer in carbonic anhydrase Q Cui, M Karplus The Journal of Physical Chemistry B 107 (4), 1071-1078, 2003	192	2003
A theoretical analysis of the proton and hydride transfer in liver alcohol dehydrogenase (LADH) Q Cui, M Elstner, M Karplus The Journal of Physical Chemistry B 106 (10), 2721-2740, 2002	189	2002

Nie można teraz wykonać tej operacji. Spróbuj ponownie później.

Prace 1–20

Cytowania rocznie

Powielone cytowania

Scalone cytowania

Dodaj współautorówWspółautorzy

Obserwuj

Cytowane przez

Współautorzy