John E. Straub
John E. Straub
Professor of Chemistry, Boston University
Verified email at bu.edu - Homepage
Title
Cited by
Cited by
Year
All-atom empirical potential for molecular modeling and dynamics studies of proteins
AD MacKerrell, D Bashford, M Bellott, RL Dunbrack, JD Evanseck, ...
J. Phys. Chem. B 102, 3586-3616, 1998
134661998
Classical and modern methods in reaction rate theory
BJ Berne, M Borkovec, JE Straub
The Journal of Physical Chemistry 92 (13), 3711-3725, 1988
4291988
Monomer adds to preformed structured oligomers of Aβ-peptides by a two-stage dock–lock mechanism
PH Nguyen, MS Li, G Stock, JE Straub, D Thirumalai
Proceedings of the National Academy of Sciences 104 (1), 111-116, 2007
3712007
Role of water in protein aggregation and amyloid polymorphism
D Thirumalai, G Reddy, JE Straub
Accounts of chemical research 45 (1), 83-92, 2011
2742011
Novel methods of sampling phase space in the simulation of biological systems
BJ Berne, JE Straub
Current Opinion in Structural Biology 7 (2), 181-189, 1997
2661997
Self-consistent parameterization of biomolecules for molecular modeling and condensed phase simulations
AD Mackerell, D Bashford, M Bellott, RL Dunbrack, MJ Field, S Fischer, ...
Faseb Journal 6 (1), A143-A143, 1992
2491992
Toward a molecular theory of early and late events in monomer to amyloid fibril formation
JE Straub, D Thirumalai
Annual review of physical chemistry 62, 437-463, 2011
2332011
A molecular switch in amyloid assembly: Met35 and amyloid β-protein oligomerization
G Bitan, B Tarus, SS Vollers, HA Lashuel, MM Condron, JE Straub, ...
Journal of the American Chemical Society 125 (50), 15359-15365, 2003
2052003
Dynamics of Asp23-Lys28 salt-bridge formation in Aβ10-35 monomers
B Tarus, JE Straub, D Thirumalai
Journal of the American Chemical Society 128 (50), 16159-16168, 2006
1982006
Generalized simulated annealing algorithms using Tsallis statistics: Application to conformational optimization of a tetrapeptide
I Andricioaei, JE Straub
Physical Review E 53 (4), R3055, 1996
1981996
Non‐Markovian activated rate processes: Comparison of current theories with numerical simulation data
JE Straub, M Borkovec, BJ Berne
The Journal of Chemical Physics 84 (3), 1788-1794, 1986
1861986
Molecular dynamics study of the photodissociation of carbon monoxide from myoglobin: ligand dynamics in the first 10 ps
JE Straub, M Karplus
Chemical physics 158 (2-3), 221-248, 1991
1851991
Entropic stabilization of proteins by TMAO
SS Cho, G Reddy, JE Straub, D Thirumalai
The Journal of Physical Chemistry B 115 (45), 13401-13407, 2011
1692011
Aqueous urea solution destabilizes Aβ16–22 oligomers
DK Klimov, JE Straub, D Thirumalai
Proceedings of the National Academy of Sciences 101 (41), 14760-14765, 2004
1672004
Global energy minimum searches using an approximate solution of the imaginary time Schrödinger equation
P Amara, D Hsu, JE Straub
The Journal of Physical Chemistry 97 (25), 6715-6721, 1993
1561993
Molecular dynamics study of an isomerizing diatomic in a Lennard‐Jones fluid
JE Straub, M Borkovec, BJ Berne
The Journal of chemical physics 89 (8), 4833-4847, 1988
1551988
The MaxFlux algorithm for calculating variationally optimized reaction paths for conformational transitions in many body systems at finite temperature
S Huo, JE Straub
The Journal of chemical physics 107 (13), 5000-5006, 1997
1481997
Influence of Preformed Asp23− Lys28 Salt Bridge on the Conformational Fluctuations of Monomers and Dimers of Aβ Peptides with Implications for Rates of Fibril Formation
G Reddy, JE Straub, D Thirumalai
The Journal of Physical Chemistry B 113 (4), 1162-1172, 2009
1422009
Development of novel statistical potentials for protein fold recognition
NV Buchete, JE Straub, D Thirumalai
Current opinion in structural biology 14 (2), 225-232, 2004
1392004
Calculation of dynamic friction on intramolecular degrees of freedom
JE Straub, M Borkovec, BJ Berne
Journal of Physical Chemistry 91 (19), 4995-4998, 1987
1381987
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