Year |
Citation |
Score |
2022 |
Patel D, Haag SL, Patel JS, Ytreberg FM, Bernards MT. Paired Simulations and Experimental Investigations into the Calcium-Dependent Conformation of Albumin. Journal of Chemical Information and Modeling. 62: 1282-1293. PMID 35194993 DOI: 10.1021/acs.jcim.1c01104 |
0.654 |
|
2021 |
Patel D, Patel JS, Ytreberg FM. Implementing and Assessing an Alchemical Method for Calculating Protein-Protein Binding Free Energy. Journal of Chemical Theory and Computation. PMID 33709712 DOI: 10.1021/acs.jctc.0c01045 |
0.719 |
|
2020 |
Yang J, Naik N, Patel JS, Wylie CS, Gu W, Huang J, Ytreberg FM, Naik MT, Weinreich DM, Rubenstein BM. Predicting the viability of beta-lactamase: How folding and binding free energies correlate with beta-lactamase fitness. Plos One. 15: e0233509. PMID 32470971 DOI: 10.1371/Journal.Pone.0233509 |
0.37 |
|
2020 |
Mirabzadeh CA, Ytreberg FM. Implementation of adaptive integration method for free energy calculations in molecular systems Peerj Computer Science. 6: e264. DOI: 10.7717/Peerj-Cs.264 |
0.363 |
|
2020 |
Patel DJ, Suresh Patel J, Ytreberg FM. Testing and Improving Alchemical Methods for Protein-Protein Binding Affinity Calculation Biophysical Journal. 118: 142a. DOI: 10.1016/J.Bpj.2019.11.898 |
0.71 |
|
2020 |
Barnes J, Martin K, Miller C, Ytreberg FM. Searching for a Mechanistic Description of Pairwise Epistasis in Protein Systems Biophysical Journal. 118: 50a. DOI: 10.1016/J.Bpj.2019.11.452 |
0.309 |
|
2019 |
Martin KP, MacKenzie SM, Barnes JW, Ytreberg FM. Protein Stability in Titan's Subsurface Water Ocean. Astrobiology. PMID 31730377 DOI: 10.1089/Ast.2018.1972 |
0.373 |
|
2019 |
Martin KP, Ytreberg FM. Comparing Binding Affinity Results from Pyrosetta and Coarse-Grained Simulations Biophysical Journal. 116: 145a. DOI: 10.1016/J.Bpj.2018.11.804 |
0.37 |
|
2019 |
Barnes J, Ytreberg FM. Assessing Foldx for Predicting Protein-Protein Binding Affinity Changes Due to Multiple Mutations Biophysical Journal. 116: 336a. DOI: 10.1016/J.Bpj.2018.11.1830 |
0.437 |
|
2019 |
Suresh Patel J, Ytreberg FM. Calculation of Protein-Protein Binding Free Energies using Umbrella Sampling with Dual Resolution Water Models Biophysical Journal. 116: 291a. DOI: 10.1016/J.Bpj.2018.11.1571 |
0.427 |
|
2017 |
Patel JS, Ytreberg FM. Fast Calculation of Protein-Protein Binding Free Energies using Umbrella Sampling with a Coarse-Grained Model. Journal of Chemical Theory and Computation. PMID 29286646 DOI: 10.1016/J.Bpj.2016.11.1087 |
0.492 |
|
2016 |
Douglas SM, Chubiz LM, Harcombe WR, Ytreberg FM, Marx CJ. Parallel Mutations Result in a Wide Range of Cooperation and Community Consequences in a Two-Species Bacterial Consortium. Plos One. 11: e0161837. PMID 27617746 DOI: 10.1371/Journal.Pone.0161837 |
0.305 |
|
2016 |
Miller CR, Johnson EL, Burke AZ, Martin KP, Miura TA, Brown CJ, Wichman HA, Ytreberg FM. Biophysical Implications of Ebola Virus Evolution Biophysical Journal. 110: 494a. DOI: 10.1016/J.Bpj.2015.11.2643 |
0.312 |
|
2015 |
Ytreberg FM, Borcherds W, Wu H, Daughdrill GW. Using chemical shifts to generate structural ensembles for intrinsically disordered proteins with converged distributions of secondary structure. Intrinsically Disordered Proteins. 3: e984565. PMID 28232883 DOI: 10.1016/J.Bpj.2014.11.1256 |
0.378 |
|
2015 |
Zhan YA, Ytreberg FM. The cis conformation of proline leads to weaker binding of a p53 peptide to MDM2 compared to trans. Archives of Biochemistry and Biophysics. 575: 22-9. PMID 25840370 DOI: 10.1016/J.Abb.2015.03.021 |
0.723 |
|
2014 |
Miller CR, Lee KH, Wichman HA, Ytreberg FM. Changing folding and binding stability in a viral coat protein: a comparison between substitutions accessible through mutation and those fixed by natural selection. Plos One. 9: e112988. PMID 25405628 DOI: 10.1371/Journal.Pone.0112988 |
0.59 |
|
2014 |
LaPorte DR, Ytreberg FM. Understanding the Evolution of Dynamics for an Intrinsically Disordered Protein Biophysical Journal. 106: 482a. DOI: 10.1016/J.Bpj.2013.11.2720 |
0.377 |
|
2014 |
Zhan Y, Ytreberg FM. The Effect of Proline CIS Trans Isomerization on P53 MDM2 Binding Biophysical Journal. 106: 481a. DOI: 10.1016/J.Bpj.2013.11.2717 |
0.742 |
|
2013 |
Zhan YA, Wu H, Powell AT, Daughdrill GW, Ytreberg FM. Impact of the K24N mutation on the transactivation domain of p53 and its binding to murine double-minute clone 2. Proteins. 81: 1738-47. PMID 23609977 DOI: 10.1002/Prot.24310 |
0.725 |
|
2013 |
Corti G, Zhan Y, Wang L, Hare B, Cantrell T, Ii MB, Prakash T, Ytreberg FM, Miller MA, Mcilroy DN. The effects of nanoscale geometry and spillover on room temperature storage of hydrogen on silica nanosprings Journal of Physics D: Applied Physics. 46. DOI: 10.1088/0022-3727/46/50/505307 |
0.665 |
|
2013 |
Zhan Y, Ytreberg FM. Absolute Binding Affinity Calculation for MDM2 Bound to a Disordered Fragment of P53 Biophysical Journal. 104: 234a. DOI: 10.1016/J.Bpj.2012.11.1320 |
0.741 |
|
2013 |
Ytreberg FM, Kashtanov S, Borcherds W, Wu H, Daughdrill GW. De Novo Generation of Bound Structures for an Intrinsically Disordered Protein using Only Alpha Carbon Chemical Shifts Biophysical Journal. 104: 191a. DOI: 10.1016/J.Bpj.2012.11.1075 |
0.374 |
|
2012 |
Pina JE, Lee KH, Ytreberg FM. Effects of the binding of calcium ions on the structure and dynamics of the ΦX174 virus investigated using molecular dynamics. Journal of Biological Physics. 38: 397-404. PMID 23729905 DOI: 10.1007/S10867-011-9260-6 |
0.532 |
|
2012 |
Kashtanov S, Borcherds W, Wu H, Daughdrill GW, Ytreberg FM. Using chemical shifts to assess transient secondary structure and generate ensemble structures of intrinsically disordered proteins. Methods in Molecular Biology (Clifton, N.J.). 895: 139-52. PMID 22760318 DOI: 10.1007/978-1-61779-927-3_11 |
0.317 |
|
2012 |
Daughdrill GW, Kashtanov S, Stancik A, Hill SE, Helms G, Muschol M, Receveur-Bréchot V, Ytreberg FM. Understanding the structural ensembles of a highly extended disordered protein. Molecular Biosystems. 8: 308-19. PMID 21979461 DOI: 10.1039/C1Mb05243H |
0.43 |
|
2012 |
Lee KH, Ytreberg FM. Effect of Gold Nanoparticle Conjugation on Peptide Dynamics and Structure Entropy. 14: 630-641. DOI: 10.3390/E14040630 |
0.459 |
|
2012 |
Kashtanov S, Ytreberg FM. Characterizing Structural Ensembles of Intrinsically Disordered Proteins Determined via a Broad Ensemble Generator with Reweighting Biophysical Journal. 102: 631a. DOI: 10.1016/J.Bpj.2011.11.3436 |
0.369 |
|
2012 |
Hao Lee K, Ytreberg FM. Sampling of Random Amino Acid Mutations: Folding and Binding Stability of Coat Proteins in a Simple Virus Biophysical Journal. 102: 456a. DOI: 10.1016/J.Bpj.2011.11.2502 |
0.464 |
|
2012 |
Ada Zhan Y, Ytreberg FM. Impact of K24N Mutation on p53TAD and its Interaction with MDM2 Biophysical Journal. 102: 447a. DOI: 10.1016/J.Bpj.2011.11.2454 |
0.435 |
|
2011 |
Lee KH, Miller CR, Nagel AC, Wichman HA, Joyce P, Ytreberg FM. First-step mutations for adaptation at elevated temperature increase capsid stability in a virus. Plos One. 6: e25640. PMID 21980515 DOI: 10.1371/Journal.Pone.0025640 |
0.528 |
|
2011 |
Shyu C, Cavileer TD, Nagler JJ, Ytreberg FM. Computational estimation of rainbow trout estrogen receptor binding affinities for environmental estrogens. Toxicology and Applied Pharmacology. 250: 322-6. PMID 21075131 DOI: 10.1016/J.Taap.2010.11.005 |
0.33 |
|
2011 |
Shyu C, Ytreberg FM. Accurate estimation of solvation free energy using polynomial fitting techniques. Journal of Computational Chemistry. 32: 134-41. PMID 20623657 DOI: 10.1002/Jcc.21609 |
0.321 |
|
2011 |
Kashtanov S, Ytreberg FM. Broad Ensemble Generator (BEG): Software to Generate Ensembles for Intrinsically Disordered Proteins Biophysical Journal. 100: 59a. DOI: 10.1016/J.Bpj.2010.12.519 |
0.362 |
|
2011 |
Lee KH, Ytreberg FM. Molecular Dynamics Study of Structural Ensembles for Peptides Bound to Gold Nanoparticles Biophysical Journal. 100: 148a. DOI: 10.1016/J.Bpj.2010.12.1013 |
0.456 |
|
2010 |
Ytreberg FM. Computational study of small molecule binding for both tethered and free conditions. The Journal of Physical Chemistry. B. 114: 5431-4. PMID 20369865 DOI: 10.1021/Jp911704N |
0.376 |
|
2010 |
Shyu C, Brown CJ, Ytreberg FM. Computational study of evolutionary selection pressure on rainbow trout estrogen receptors. Plos One. 5: e9392. PMID 20231885 DOI: 10.1371/Journal.Pone.0009392 |
0.314 |
|
2010 |
Lee KH, Ytreberg FM. Toward Understanding the Effect of Single Amino Acid Mutations on Viral Capsid Stability Biophysical Journal. 98: 655a. DOI: 10.1016/J.Bpj.2009.12.3593 |
0.555 |
|
2009 |
Ytreberg FM. Absolute FKBP binding affinities obtained via nonequilibrium unbinding simulations. The Journal of Chemical Physics. 130: 164906. PMID 19405629 DOI: 10.1063/1.3119261 |
0.426 |
|
2009 |
Shyu C, Ytreberg FM. Reducing the bias and uncertainty of free energy estimates by using regression to fit thermodynamic integration data. Journal of Computational Chemistry. 30: 2297-304. PMID 19266482 DOI: 10.1002/Jcc.21231 |
0.302 |
|
2007 |
Ytreberg FM, Aroutiounian SKh, Zuckerman DM. Demonstrated Convergence of the Equilibrium Ensemble for a Fast United-Residue Protein Model. Journal of Chemical Theory and Computation. 3: 1860-6. PMID 26627628 DOI: 10.1021/Ct700076T |
0.373 |
|
2007 |
Ytreberg FM. Using non-equilibrium simulations to estimate equilibrium binding affinities Aip Conference Proceedings. 978: 65-74. DOI: 10.1063/1.2891414 |
0.301 |
|
2006 |
Ytreberg FM, Swendsen RH, Zuckerman DM. Comparison of free energy methods for molecular systems. The Journal of Chemical Physics. 125: 184114. PMID 17115745 DOI: 10.1063/1.2378907 |
0.307 |
|
2006 |
Ytreberg FM, Zuckerman DM. Simple estimation of absolute free energies for biomolecules. The Journal of Chemical Physics. 124: 104105. PMID 16542066 DOI: 10.1063/1.2174008 |
0.355 |
|
2005 |
Ytreberg FM, Zuckerman DM. Peptide conformational equilibria computed via a single-stage shifting protocol. The Journal of Physical Chemistry. B. 109: 9096-103. PMID 16852082 DOI: 10.1021/Jp0510692 |
0.351 |
|
2004 |
Ytreberg FM, Zuckerman DM. Efficient use of nonequilibrium measurement to estimate free energy differences for molecular systems. Journal of Computational Chemistry. 25: 1749-59. PMID 15362132 DOI: 10.1002/Jcc.20103 |
0.305 |
|
2004 |
Ytreberg FM, Zuckerman DM. Single-ensemble nonequilibrium path-sampling estimates of free energy differences. The Journal of Chemical Physics. 120: 10876-9. PMID 15268117 DOI: 10.1063/1.1760511 |
0.302 |
|
2003 |
Ytreberg FM, McKay SR. Model for the effect of ramping rate on ferrofluid aggregates Digests of the Intermag Conference. DOI: 10.1109/INTMAG.2003.1230774 |
0.565 |
|
2000 |
Ytreberg FM, McKay SR. Calculated properties of field-induced aggregates in ferrofluids Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 61: 4107-10. PMID 11088204 |
0.592 |
|
1999 |
Ytreberg FM, McKay SR. Second mechanism for transitions in a reaction diffusion system Physical Review E - Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 59: 3376-3381. DOI: 10.1103/Physreve.59.3376 |
0.588 |
|
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