Year |
Citation |
Score |
2023 |
Bogetti AT, Leung JMG, Russo JD, Zhang S, Thompson JP, Saglam AS, Ray D, Mostofian B, Pratt AJ, Abraham RC, Harrison PO, Dudek M, Torrillo PA, DeGrave AJ, Adhikari U, ... ... Adelman JL, et al. A Suite of Tutorials for the WESTPA 2.0 Rare-Events Sampling Software [Article v2.0]. Living Journal of Computational Molecular Science. 5. PMID 37200895 DOI: 10.33011/livecoms.5.1.1655 |
0.762 |
|
2022 |
Russo JD, Zhang S, Leung JMG, Bogetti AT, Thompson JP, DeGrave AJ, Torrillo PA, Pratt AJ, Wong KF, Xia J, Copperman J, Adelman JL, Zwier MC, LeBard DN, Zuckerman DM, et al. WESTPA 2.0: High-Performance Upgrades for Weighted Ensemble Simulations and Analysis of Longer-Timescale Applications. Journal of Chemical Theory and Computation. PMID 35043623 DOI: 10.1021/acs.jctc.1c01154 |
0.755 |
|
2019 |
Bogetti AT, Mostofian B, Dickson A, Pratt AJ, Saglam AS, Harrison PO, Adelman JL, Dudek M, Torrillo PA, DeGrave AJ, Adhikari U, Zwier MC, Zuckerman DM, Chong LT. A Suite of Tutorials for the WESTPA Rare-Events Sampling Software [Article v1.0]. Living Journal of Computational Molecular Science. 1. PMID 32395705 DOI: 10.33011/livecoms.1.2.10607 |
0.76 |
|
2017 |
Capponi S, Adelman J, Rosenberg J, Grabe M. Weighted Ensemble Approach to In Silico Measure the I-V Relationship in a K + Ion Channel Biophysical Journal. 112: 543a. DOI: 10.1016/J.Bpj.2016.11.2933 |
0.64 |
|
2017 |
Suárez E, Adelman JL, Zuckerman DM. Mechanism Beyond Markov Models: History Information is Needed for Unbiased Pathway Reconstruction of Protein Folding Biophysical Journal. 112: 289a-290a. DOI: 10.1016/J.Bpj.2016.11.1569 |
0.644 |
|
2016 |
Zwier MC, Pratt A, Adelman JL, Kaus JW, Zuckerman DM, Chong LT. Efficient Atomistic Simulation of Pathways and Calculation of Rate Constants for a Protein-Peptide Binding Process: Application to the MDM2 Protein and an Intrinsically Disordered p53 Peptide. The Journal of Physical Chemistry Letters. PMID 27532687 DOI: 10.1021/Acs.Jpclett.6B01502 |
0.749 |
|
2016 |
Suárez E, Adelman JL, Zuckerman DM. Accurate estimation of protein folding and unfolding times: Beyond Markov state models. Journal of Chemical Theory and Computation. PMID 27340835 DOI: 10.1021/Acs.Jctc.6B00339 |
0.622 |
|
2016 |
Adelman JL, Ghezzi C, Bisignano P, Loo DD, Choe S, Abramson J, Rosenberg JM, Wright EM, Grabe M. Stochastic steps in secondary active sugar transport. Proceedings of the National Academy of Sciences of the United States of America. PMID 27325773 DOI: 10.1073/Pnas.1525378113 |
0.697 |
|
2015 |
Adelman JL, Grabe M. Simulating current-voltage relationships for a narrow ion channel using the weighted ensemble method. Journal of Chemical Theory and Computation. 11: 1907-1918. PMID 26392816 DOI: 10.1021/Ct501134S |
0.716 |
|
2015 |
Zwier MC, Adelman JL, Kaus JW, Pratt AJ, Wong KF, Rego NB, Suárez E, Lettieri S, Wang DW, Grabe M, Zuckerman DM, Chong LT. WESTPA: An interoperable, highly scalable software package for weighted ensemble simulation and analysis. Journal of Chemical Theory and Computation. 11: 800-809. PMID 26392815 DOI: 10.1021/Ct5010615 |
0.78 |
|
2015 |
Buck TM, Jordan R, Lyons-Weiler J, Adelman JL, Needham PG, Kleyman TR, Brodsky JL. Expression of three topologically distinct membrane proteins elicits unique stress response pathways in the yeast Saccharomyces cerevisiae. Physiological Genomics. 47: 198-214. PMID 25759377 DOI: 10.1152/Physiolgenomics.00101.2014 |
0.314 |
|
2015 |
Zwier MC, Adelman JL, Kaus JW, Pratt AJ, Wong KF, Rego NB, Suárez E, Lettieri S, Wang DW, Grabe M, Zuckerman DM, Chong LT. WESTPA: An interoperable, highly scalable software package for weighted ensemble simulation and analysis Journal of Chemical Theory and Computation. 11: 800-809. DOI: 10.1021/ct5010615 |
0.763 |
|
2014 |
Choudhary OP, Paz A, Adelman JL, Colletier JP, Abramson J, Grabe M. Structure-guided simulations illuminate the mechanism of ATP transport through VDAC1. Nature Structural & Molecular Biology. 21: 626-32. PMID 24908397 DOI: 10.1038/Nsmb.2841 |
0.771 |
|
2014 |
Adelman JL, Sheng Y, Choe S, Abramson J, Wright EM, Rosenberg JM, Grabe M. Structural determinants of water permeation through the sodium-galactose transporter vSGLT. Biophysical Journal. 106: 1280-9. PMID 24655503 DOI: 10.1016/J.Bpj.2014.01.006 |
0.703 |
|
2014 |
Choudhary OP, Paz A, Adelman J, Colletier J, Abramson J, Grabe M. Characterizing ATP Permeation through the Voltage-Dependent Anion Channel VDAC Biophysical Journal. 106: 147a-148a. DOI: 10.1016/J.Bpj.2013.11.851 |
0.751 |
|
2014 |
Adelman JL, Grabe M. Simulating Current-Voltage Relationships for a Simple Ion Channel with All-Atom Resolution using the Weighted Ensemble Method Biophysical Journal. 106: 805a. DOI: 10.1016/J.Bpj.2013.11.4411 |
0.697 |
|
2014 |
Pendse P, Choe S, Adelman J, Abramson J, Wright E, Rosenberg J, Grabe M. Energetics of Urea Permeation through Sodium-Dependent Galactose Cotransporter vSGLT Biophysical Journal. 106: 365a. DOI: 10.1016/J.Bpj.2013.11.2072 |
0.722 |
|
2014 |
Adelman JL, Sheng Y, Choe S, Abramson J, Wright EM, Grabe M. Insight into the Mechanism of Water Permeation through the Sodium-Galactose Transporter vSGLT from Long Molecular Dynamics Simulations Biophysical Journal. 106: 365a. DOI: 10.1016/J.Bpj.2013.11.2071 |
0.697 |
|
2013 |
Adelman JL, Grabe M. Simulating rare events using a weighted ensemble-based string method. The Journal of Chemical Physics. 138: 044105. PMID 23387566 DOI: 10.1063/1.4773892 |
0.682 |
|
2013 |
Adelman JL, Grabe M. Efficient Simulation of Complex Transition Pathways using a Weighted Ensemble Based String Method Biophysical Journal. 104: 504a. DOI: 10.1016/J.Bpj.2012.11.2781 |
0.709 |
|
2012 |
Adelman JL, Dale AL, Zwier MC, Bhatt D, Chong LT, Zuckerman DM, Grabe M. Insight into the Alternating Access Mechanism of the Sodium Symporter Mhp1 using Path Sampling Simulations Biophysical Journal. 102: 661a-662a. DOI: 10.1016/J.Bpj.2011.11.3604 |
0.79 |
|
2012 |
Choe S, Adelman JL, Rosenberg JM, Wright EM, Abramson J, Grabe M. Understanding Substrate Unbinding from the Sodium-Galactose Co-Transporter vSGLT based on 16 Microseconds of Molecular Simulation Biophysical Journal. 102: 661a. DOI: 10.1016/J.Bpj.2011.11.3603 |
0.72 |
|
2012 |
Choudhary OP, Adelman J, Abramson J, Grabe M. Characterizing ATP Permeation through mVDAC1 using Markov State Models (MSMs) Biophysical Journal. 102: 550a. DOI: 10.1016/J.Bpj.2011.11.3002 |
0.752 |
|
2011 |
Adelman JL, Dale AL, Zwier MC, Bhatt D, Chong LT, Zuckerman DM, Grabe M. Simulations of the alternating access mechanism of the sodium symporter Mhp1. Biophysical Journal. 101: 2399-407. PMID 22098738 DOI: 10.1016/J.Bpj.2011.09.061 |
0.783 |
|
2011 |
Kashlan OB, Adelman JL, Okumura S, Blobner BM, Zuzek Z, Hughey RP, Kleyman TR, Grabe M. Constraint-based, homology model of the extracellular domain of the epithelial Na+ channel α subunit reveals a mechanism of channel activation by proteases. The Journal of Biological Chemistry. 286: 649-60. PMID 20974852 DOI: 10.1074/Jbc.M110.167098 |
0.674 |
|
2010 |
Adelman JL, Chodera JD, Kuo IF, Miller TF, Barsky D. The mechanical properties of PCNA: implications for the loading and function of a DNA sliding clamp. Biophysical Journal. 98: 3062-9. PMID 20550919 DOI: 10.1016/J.Bpj.2010.03.056 |
0.356 |
|
2006 |
Adelman JL, Jeong YJ, Liao JC, Patel G, Kim DE, Oster G, Patel SS. Mechanochemistry of transcription termination factor Rho. Molecular Cell. 22: 611-21. PMID 16762834 DOI: 10.1016/J.Molcel.2006.04.022 |
0.716 |
|
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