PubRank

Peter G Bolhuis

Author PubWeight™ 30.98‹?›

Top papers

Rank Title Journal Year PubWeight™‹?›
1 Rate constants for diffusive processes by partial path sampling. J Chem Phys 2004 1.29
2 Rate constant and reaction coordinate of Trp-cage folding in explicit water. Biophys J 2008 1.26
3 Predicting the reaction coordinates of millisecond light-induced conformational changes in photoactive yellow protein. Proc Natl Acad Sci U S A 2010 1.02
4 Interplay between structure and size in a critical crystal nucleus. Phys Rev Lett 2005 1.00
5 The reweighted path ensemble. J Chem Phys 2010 0.99
6 Multiple state transition path sampling. J Chem Phys 2008 0.95
7 Folding dynamics of the Trp-cage miniprotein: evidence for a native-like intermediate from combined time-resolved vibrational spectroscopy and molecular dynamics simulations. J Phys Chem B 2013 0.94
8 Hysteresis in clay swelling induced by hydrogen bonding: accurate prediction of swelling states. Langmuir 2006 0.92
9 Reaction coordinates, one-dimensional Smoluchowski equations, and a test for dynamical self-consistency. J Chem Phys 2013 0.91
10 Predicting the signaling state of photoactive yellow protein. Biophys J 2005 0.90
11 Elucidating the locking mechanism of peptides onto growing amyloid fibrils through transition path sampling. Biophys J 2012 0.90
12 A molecular mechanism of hysteresis in clay swelling. Angew Chem Int Ed Engl 2004 0.90
13 Role of the prestructured surface cloud in crystal nucleation. Phys Rev Lett 2011 0.86
14 Anisotropic aggregation in a simple model of isotropically polymer-coated nanoparticles. Phys Rev E Stat Nonlin Soft Matter Phys 2013 0.85
15 Reaction coordinates for the crystal nucleation of colloidal suspensions extracted from the reweighted path ensemble. J Chem Phys 2011 0.85
16 Adaptive single replica multiple state transition interface sampling. J Chem Phys 2013 0.84
17 Accurate free energies of micelle formation. J Phys Chem B 2005 0.83
18 Nonlinear reaction coordinate analysis in the reweighted path ensemble. J Chem Phys 2010 0.82
19 Confinement-induced states in the folding landscape of the Trp-cage miniprotein. J Phys Chem B 2012 0.82
20 The influence of micelle formation on the stability of colloid surfactant mixtures. Phys Chem Chem Phys 2010 0.80
21 Multiple state transition interface sampling of alanine dipeptide in explicit solvent. J Chem Phys 2011 0.80
22 Simultaneous computation of free energies and kinetics of rare events. Phys Rev E Stat Nonlin Soft Matter Phys 2005 0.80
23 The HAMP signal relay domain adopts multiple conformational states through collective piston and tilt motions. PLoS Comput Biol 2013 0.79
24 Helix formation is a dynamical bottleneck in the recovery reaction of Photoactive Yellow Protein. Proteins 2008 0.79
25 Hydrophobic collapse of trigger factor monomer in solution. PLoS One 2013 0.79
26 Interplay between folding and assembly of fibril-forming polypeptides. Phys Rev Lett 2013 0.79
27 (Un)Folding mechanisms of the FBP28 WW domain in explicit solvent revealed by multiple rare event simulation methods. Biophys J 2010 0.79
28 Crystallizing hard-sphere glasses by doping with active particles. Soft Matter 2014 0.79
29 Can purely repulsive soft potentials predict micelle formation correctly? Phys Chem Chem Phys 2005 0.78
30 Effects of a mutation on the folding mechanism of a beta-hairpin. J Phys Chem B 2009 0.78
31 Protonation of the chromophore in the photoactive yellow protein. J Phys Chem B 2007 0.78
32 Statics and dynamics of free and hydrogen-bonded OH groups at the air/water interface. J Phys Chem B 2012 0.78
33 Equilibrium and non-equilibrium cluster phases in colloids with competing interactions. Soft Matter 2014 0.78
34 Sampling the kinetic pathways of a micelle fusion and fission transition. J Chem Phys 2007 0.78
35 Effect of excluded volume interactions on the interfacial properties of colloid-polymer mixtures. J Chem Phys 2008 0.77
36 Reordering hydrogen bonds using hamiltonian replica exchange enhances sampling of conformational changes in biomolecular systems. J Phys Chem B 2009 0.77
37 The self-assembly mechanism of fibril-forming silk-based block copolymers. Phys Chem Chem Phys 2011 0.77
38 Temperature-sensitive colloidal phase behavior induced by critical Casimir forces. J Chem Phys 2013 0.77
39 Prediction of a stable associated liquid of short amyloidogenic peptides. Phys Chem Chem Phys 2015 0.76
40 On the efficiency of biased sampling of the multiple state path ensemble. J Chem Phys 2010 0.75
41 Application to large systems: general discussion. Faraday Discuss 2016 0.75
42 A simple coarse-grained model for self-assembling silk-like protein fibers. Faraday Discuss 2010 0.75
43 Solvation of p-coumaric acid in water. J Phys Chem B 2007 0.75
44 New methods: general discussion. Faraday Discuss 2016 0.75
45 Modelling critical Casimir force induced self-assembly experiments on patchy colloidal dumbbells. Soft Matter 2017 0.75
46 Numerical study of the effect of thiol-disulfide exchange in the cluster phase of beta-lactoglobulin aggregation. Faraday Discuss 2012 0.75
47 Trigger sequence can influence final morphology in the self-assembly of asymmetric telechelic polymers. Soft Matter 2016 0.75
48 Prediction of an autocatalytic replication mechanism for micelle formation. Phys Rev Lett 2006 0.75
49 Role of fluctuations in ligand binding cooperativity of membrane receptors. Phys Rev Lett 2011 0.75
50 Fundamentals: general discussion. Faraday Discuss 2016 0.75
51 Non-adiabatic reactions: general discussion. Faraday Discuss 2016 0.75
52 Rate Prediction for Homogeneous Nucleation of Methane Hydrate at Moderate Supersaturation Using Transition Interface Sampling. J Phys Chem B 2020 0.75