Alan E. Mark

引用先

	すべて	2019 年以来
引用	63502	24550
h 指標	90	51
i10 指標	212	140

4300

2150

1075

3225

19961997199819992000200120022003200420052006200720082009201020112012201320142015201620172018201920202021202220232024183 173 242 333 326 441 523 606 898 992 1272 1462 1843 1996 2225 2454 2772 2805 3105 3063 3359 3390 3764 3756 3801 4207 4228 4291 4265

オープンアクセス

すべて表示

40 件の論文

24 件の論文

利用可能

利用不可

助成機関の要件に基づく

共著者

Siewert J. MarrinkProfessor of Molecular Dynamics, University of Groningen確認したメールアドレス: rug.nl
Xavier DauraUNIVERSIDAD AUTONOMA DE BARCELONA確認したメールアドレス: uab.cat
Alpesh MALDE (Alpeshkumar K MALD...Griffith University確認したメールアドレス: griffith.edu.au
David PogerMicroscopy Australia, The University of Sydney確認したメールアドレス: sydney.edu.au
Gerrit GroenhofDepartment of Chemistry & Nanoscience Center, University of Jyväskylä確認したメールアドレス: jyu.fi
Alessandra VillaKTH - Royal Institute of Technology確認したメールアドレス: kth.se
Chris OostenbrinkUniversity of Natural Resources and Life Sciences, Vienna確認したメールアドレス: boku.ac.at
Martin StroetUniversity of Queensland確認したメールアドレス: uq.edu.au
Berk HessKTH Royal Institute of Technology, Stockholm, Sweden; Science for Life Laboratory, Stockholm, Sweden確認したメールアドレス: scilifelab.se
Erik LindahlProfessor of Biophysics, Stockholm University & KTH, Science for Life Laboratory確認したメールアドレス: dbb.su.se
David van der SpoelProfessor of Biology, Uppsala University確認したメールアドレス: xray.bmc.uu.se
Dr Pramod C NairSenior Research Fellow at Flinders University確認したメールアドレス: flinders.edu.au
Megan O'MaraProfessor, Australian Institute for Bioengineering and Nanotechnology, University of Queensland確認したメールアドレス: uq.edu.au
Bertrand CaronSchool of Chemistry & Molecular Biosciences, The University of Queensland確認したメールアドレス: uqconnect.edu.au
Hari LeontiadouPost-doc associate確認したメールアドレス: bioacademy.gr
Hao FanBioinformatics Institute, A*STAR Singapore確認したメールアドレス: bii.a-star.edu.sg
Danilo RoccatanoSchool of Engineering and Physical Science, University of Lincoln, Lincoln, UK確認したメールアドレス: lincoln.ac.uk
Bostjan KobeProfessor of Structural Biology, The University of Queensland確認したメールアドレス: uq.edu.au
Paul BurnCentre for Organic Photonics & Electronics, The University of Queensland確認したメールアドレス: uq.edu.au
Marco FioroniUniversity of Memphis確認したメールアドレス: memphis.edu

フォロー

Alan E. Mark

Professor of Biophysical Chemistry, University of Queensland

確認したメールアドレス: uq.edu.au - ホームページ

Molecular simulation GROMOS molecular dynamics protein folding Free Energy Calculations


タイトル引用回数順公開年順タイトル順	引用先引用先	年
GROMACS: fast, flexible, and free D Van Der Spoel, E Lindahl, B Hess, G Groenhof, AE Mark, ... Journal of computational chemistry 26 (16), 1701-1718, 2005	17067	2005
A biomolecular force field based on the free enthalpy of hydration and solvation: the GROMOS force‐field parameter sets 53A5 and 53A6 C Oostenbrink, A Villa, AE Mark, WF Van Gunsteren Journal of computational chemistry 25 (13), 1656-1676, 2004	4371	2004
Biomolecular simulation: the GROMOS96 manual and user guide WF van Gunsteren, SR Billeter, AA Eising, PH Hünenberger, P Krüger, ... Vdf Hochschulverlag AG an der ETH Zürich, Zürich 86, 1-1044, 1996	3050*	1996
Coarse grained model for semiquantitative lipid simulations SJ Marrink, AH De Vries, AE Mark The Journal of Physical Chemistry B 108 (2), 750-760, 2004	2635	2004
Definition and testing of the GROMOS force-field versions 54A7 and 54B7 N Schmid, AP Eichenberger, A Choutko, S Riniker, M Winger, AE Mark, ... European biophysics journal 40, 843-856, 2011	2458	2011
Peptide folding: when simulation meets experiment X Daura, K Gademann, B Jaun, D Seebach, WF Van Gunsteren, AE Mark Angewandte Chemie International Edition 38 (1‐2), 236-240, 1999	2192	1999
GROMACS: fast, flexible, and free DVD Spoel, E Lindahl, B Hess, G Groenhof, AE Mark, HJC Berendsen J Comput Chem 26 (16), 1701-1718, 2005	1944	2005
The GROMOS biomolecular simulation program package WRP Scott, PH Hünenberger, IG Tironi, AE Mark, SR Billeter, J Fennen, ... The Journal of Physical Chemistry A 103 (19), 3596-3607, 1999	1892	1999
An Automated force field Topology Builder (ATB) and repository: version 1.0 AK Malde, L Zuo, M Breeze, M Stroet, D Poger, PC Nair, C Oostenbrink, ... Journal of Chemical Theory and Computation 7 (12), 4026–4037, 2011	1830	2011
Avoiding singularities and numerical instabilities in free energy calculations based on molecular simulations TC Beutler, AE Mark, RC van Schaik, PR Gerber, WF Van Gunsteren Chemical physics letters 222 (6), 529-539, 1994	1223	1994
Toroidal pores formed by antimicrobial peptides show significant disorder D Sengupta, H Leontiadou, AE Mark, SJ Marrink Biochimica et Biophysica Acta (BBA)-Biomembranes 1778 (10), 2308-2317, 2008	685	2008
Mechanism by which 2, 2, 2-trifluoroethanol/water mixtures stabilize secondary-structure formation in peptides: a molecular dynamics study D Roccatano, G Colombo, M Fioroni, AE Mark Proceedings of the National Academy of Sciences 99 (19), 12179-12184, 2002	628	2002
Antimicrobial peptides in action H Leontiadou, AE Mark, SJ Marrink Journal of the American Chemical Society 128 (37), 12156-12161, 2006	565	2006
Simulation of pore formation in lipid bilayers by mechanical stress and electric fields DP Tieleman, H Leontiadou, AE Mark, SJ Marrink Journal of the American Chemical Society 125 (21), 6382-6383, 2003	557	2003
Testing and validation of the Automated Topology Builder (ATB) version 2.0: prediction of hydration free enthalpies KB Koziara, M Stroet, AK Malde, AE Mark Journal of computer-aided molecular design 28, 221-233, 2014	539	2014
Parametrization of aliphatic CHn united atoms of GROMOS96 force field X Daura, AE Mark, WF Van Gunsteren Journal of computational chemistry 19 (5), 535-547, 1998	535	1998
Basic ingredients of free energy calculations: a review CD Christ, AE Mark, WF Van Gunsteren Journal of computational chemistry 31 (8), 1569-1582, 2010	482	2010
Fluctuation and cross-correlation analysis of protein motions observed in nanosecond molecular dynamics simulations PH Hünenberger, AE Mark, WF Van Gunsteren Journal of molecular biology 252 (4), 492-503, 1995	464	1995
Folding–unfolding thermodynamics of a β‐heptapeptide from equilibrium simulations X Daura, WF van Gunsteren, AE Mark Proteins: structure, function, and bioinformatics 34 (3), 269-280, 1999	460	1999
Reversible peptide folding in solution by molecular dynamics simulation X Daura, B Jaun, D Seebach, WF Van Gunsteren, AE Mark Journal of molecular biology 280 (5), 925-932, 1998	457	1998

現在システムで処理を実行できません。しばらくしてからもう一度お試しください。

論文 1–20

年間引用数

重複した引用

結合された引用

共著者を追加共著者

フォロー

引用先

共著者