| Year |
Citation |
Score |
| 2020 |
Teng X, Liu B, Ichiye T. Understanding how water models affect the anomalous pressure dependence of their diffusion coefficients. The Journal of Chemical Physics. 153: 104510. PMID 32933292 DOI: 10.1063/5.0021472 |
0.364 |
|
| 2020 |
Teng X, Ichiye T. Dynamical Model for the Counteracting Effects of Trimethylamine N-Oxide on Urea in Aqueous Solutions under Pressure. The Journal of Physical Chemistry. B. PMID 32059113 DOI: 10.1021/Acs.Jpcb.9B10844 |
0.368 |
|
| 2019 |
Mason PE, Tavagnacco L, Saboungi ML, Hansen TC, Fischer HE, Neilson GW, Ichiye T, Brady JW. Molecular Dynamics and Neutron Scattering Studies of Potassium Chloride in Aqueous Solution. The Journal of Physical Chemistry. B. PMID 31769976 DOI: 10.1021/Acs.Jpcb.9B08422 |
0.34 |
|
| 2019 |
Huang Q, Rodgers JM, Hemley RJ, Ichiye T. Adaptations for Pressure and Temperature Effects on Loop Motion in and Dihydrofolate Reductase. High Pressure Research. 39: 225-237. PMID 31359910 DOI: 10.1080/08957959.2019.1584799 |
0.339 |
|
| 2019 |
Huang Q, Rodgers JM, Hemley RJ, Ichiye T. Effects of Pressure and Temperature on the Atomic Fluctuations of Dihydrofolate Reductase from a Psychropiezophile and a Mesophile. International Journal of Molecular Sciences. 20. PMID 30909394 DOI: 10.3390/Ijms20061452 |
0.363 |
|
| 2019 |
Tran KN, Niu S, Ichiye T. Reduction potential calculations of the Fe-S clusters in Thermus thermophilus respiratory complex I. Journal of Computational Chemistry. PMID 30697773 DOI: 10.1002/Jcc.25785 |
0.36 |
|
| 2019 |
Teng X, Ichiye T. Dynamical Effects of Trimethylamine N-Oxide on Aqueous Solutions of Urea. The Journal of Physical Chemistry. B. PMID 30638025 DOI: 10.1021/Acs.Jpcb.8B09874 |
0.34 |
|
| 2019 |
Penhallurick R, Hoopes JT, Ichiye T, Teixeira S. Pressure-Effects and Adaptation Mechanisms of Ambient and Deep-Sea Bacterial Enzymes Biophysical Journal. 116: 342a. DOI: 10.1016/J.Bpj.2018.11.1864 |
0.624 |
|
| 2019 |
Teixeira SC, Penhallurick R, Hoopes JT, Hemley RJ, Ichiye T. High-Pressure Structural Studies of Dihydrofolate Reductase in Solution Biophysical Journal. 116: 336a. DOI: 10.1016/J.Bpj.2018.11.1831 |
0.644 |
|
| 2018 |
Teng X, Huang Q, Dharmawardhana CC, Ichiye T. Diffusion of aqueous solutions of ionic, zwitterionic, and polar solutes. The Journal of Chemical Physics. 148: 222827. PMID 29907024 DOI: 10.1063/1.5023004 |
0.321 |
|
| 2018 |
Huang Q, Rodgers JM, Hemley RJ, Ichiye T. Quasiharmonic Analysis of the Energy Landscapes of Dihydrofolate Reductase from Piezophiles and Mesophiles. The Journal of Physical Chemistry. B. PMID 29370701 DOI: 10.1021/Acs.Jpcb.7B11838 |
0.392 |
|
| 2018 |
Ichiye T. Enzymes from Piezophiles. Seminars in Cell & Developmental Biology. PMID 29331641 DOI: 10.1016/J.Semcdb.2018.01.004 |
0.316 |
|
| 2017 |
Dharmawardhana CC, Ichiye T. Building better water models using the shape of the charge distribution of a water molecule. The Journal of Chemical Physics. 147: 194103. PMID 29166096 DOI: 10.1063/1.4986070 |
0.409 |
|
| 2017 |
Rodgers JM, Hemley RJ, Ichiye T. Quasiharmonic analysis of protein energy landscapes from pressure-temperature molecular dynamics simulations. The Journal of Chemical Physics. 147: 125103. PMID 28964004 DOI: 10.1063/1.5003823 |
0.38 |
|
| 2017 |
Huang Q, Rodgers JM, Hemley RJ, Ichiye T. Extreme biophysics: Enzymes under pressure. Journal of Computational Chemistry. PMID 28101963 DOI: 10.1002/Jcc.24737 |
0.328 |
|
| 2017 |
Rodgers JM, Ichiye T. Multipole moments of water molecules and the aqueous solvation of monovalent ions Journal of Molecular Liquids. 228: 54-62. DOI: 10.1016/J.Molliq.2016.10.007 |
0.381 |
|
| 2017 |
Huang Q, Rodgers JM, Hemley RJ, Ichiye T. What Makes Enzymes Work? Exploring Protein Dynamics in P-T-X Biophysical Journal. 112: 353a. DOI: 10.1016/J.Bpj.2016.11.1913 |
0.337 |
|
| 2016 |
Ichiye T. What makes proteins work: exploring life in P-T-X. Physical Biology. 13: 063001. PMID 27845917 DOI: 10.1088/1478-3975/13/6/063001 |
0.353 |
|
| 2016 |
Tran KN, Tan ML, Ichiye T. A single-site multipole model for liquid water. The Journal of Chemical Physics. 145: 034501. PMID 27448890 DOI: 10.1063/1.4958621 |
0.406 |
|
| 2015 |
Tan ML, Tran K, Pickard FC, Simmonett AC, Brooks BR, Ichiye T. Molecular Multipole Potential Energy Functions for Water. The Journal of Physical Chemistry. B. PMID 26562223 DOI: 10.1021/Acs.Jpcb.5B09565 |
0.425 |
|
| 2015 |
Tan ML, Perrin BS, Niu S, Huang Q, Ichiye T. Protein dynamics and the all-ferrous [Fe4 S4 ] cluster in the nitrogenase iron protein. Protein Science : a Publication of the Protein Society. PMID 26271353 DOI: 10.1002/Pro.2772 |
0.369 |
|
| 2015 |
Cendagorta JR, Ichiye T. The Surface Potential of the Water-Vapor Interface from Classical Simulations. The Journal of Physical Chemistry. B. 119: 9114-22. PMID 25714627 DOI: 10.1021/Jp508878V |
0.398 |
|
| 2015 |
Tan ML, Miller BT, Te J, Cendagorta JR, Brooks BR, Ichiye T. Hydrophobic hydration and the anomalous partial molar volumes in ethanol-water mixtures. The Journal of Chemical Physics. 142: 064501. PMID 25681917 DOI: 10.1063/1.4906750 |
0.333 |
|
| 2015 |
Tran KN, Ichiye T. The Electron Transfer in Ferredoxins Biophysical Journal. 108: 603a. DOI: 10.1016/J.Bpj.2014.11.3285 |
0.372 |
|
| 2014 |
Tan ML, Cendagorta JR, Ichiye T. The molecular charge distribution, the hydration shell, and the unique properties of liquid water. The Journal of Chemical Physics. 141: 244504. PMID 25554164 DOI: 10.1063/1.4904263 |
0.372 |
|
| 2014 |
Perrin BS, Miller BT, Schalk V, Woodcock HL, Brooks BR, Ichiye T. Web-based computational chemistry education with CHARMMing III: Reduction potentials of electron transfer proteins. Plos Computational Biology. 10: e1003739. PMID 25058418 DOI: 10.1371/Journal.Pcbi.1003739 |
0.439 |
|
| 2013 |
Perrin BS, Ichiye T. Identifying sequence determinants of reduction potentials of metalloproteins. Journal of Biological Inorganic Chemistry : Jbic : a Publication of the Society of Biological Inorganic Chemistry. 18: 599-608. PMID 23690205 DOI: 10.1007/S00775-013-1004-6 |
0.405 |
|
| 2013 |
Perrin BS, Ichiye T. Identifying residues that cause pH-dependent reduction potentials. Biochemistry. 52: 3022-4. PMID 23607577 DOI: 10.1021/Bi4002858 |
0.358 |
|
| 2013 |
Tan ML, Cendagorta JR, Ichiye T. Effects of microcomplexity on hydrophobic hydration in amphiphiles. Journal of the American Chemical Society. 135: 4918-21. PMID 23506339 DOI: 10.1021/Ja312504Q |
0.405 |
|
| 2013 |
Perrin BS, Ichiye T. Characterizing the effects of the protein environment on the reduction potentials of metalloproteins. Journal of Biological Inorganic Chemistry : Jbic : a Publication of the Society of Biological Inorganic Chemistry. 18: 103-10. PMID 23229112 DOI: 10.1007/S00775-012-0955-3 |
0.386 |
|
| 2013 |
Perrin BS, Niu S, Ichiye T. Calculating standard reduction potentials of [4Fe-4S] proteins. Journal of Computational Chemistry. 34: 576-82. PMID 23115132 DOI: 10.1002/Jcc.23169 |
0.423 |
|
| 2013 |
Ichiye T. Computational Tools for Predicting and Studying Redox Potentials of Metalloproteins Biophysical Journal. 104: 490a. DOI: 10.1016/J.Bpj.2012.11.2700 |
0.39 |
|
| 2012 |
Luo Y, Niu S, Ichiye T. Understanding rubredoxin redox sites by density functional theory studies of analogues. The Journal of Physical Chemistry. A. 116: 8918-24. PMID 22881577 DOI: 10.1021/Jp3057509 |
0.395 |
|
| 2011 |
Mitra D, Pelmenschikov V, Guo Y, Case DA, Wang H, Dong W, Tan ML, Ichiye T, Jenney FE, Adams MW, Yoda Y, Zhao J, Cramer SP. Dynamics of the [4Fe-4S] cluster in Pyrococcus furiosus D14C ferredoxin via nuclear resonance vibrational and resonance Raman spectroscopies, force field simulations, and density functional theory calculations. Biochemistry. 50: 5220-35. PMID 21500788 DOI: 10.1021/Bi200046P |
0.333 |
|
| 2011 |
Niu S, Ichiye T. Density functional theory calculations of redox properties of iron-sulphur protein analogues Molecular Simulation. 37: 572-590. DOI: 10.1080/08927022.2011.582111 |
0.369 |
|
| 2011 |
Tan M, Luo Y, Ichiye T. Tuning the Intramolecular Electron Transfer in 2[4Fe-4S] Ferredoxin: A Molecular Dynamics Study Biophysical Journal. 100. DOI: 10.1016/J.Bpj.2010.12.924 |
0.404 |
|
| 2010 |
Te JA, Tan ML, Ichiye T. Solvation of Glucose, Trehalose, and Sucrose by the Soft Sticky Dipole-Quadrupole-Octupole Water Model. Chemical Physics Letters. 491: 218-223. PMID 21072255 DOI: 10.1016/J.Cplett.2010.04.020 |
0.377 |
|
| 2010 |
Te JA, Ichiye T. UNDERSTANDING STRUCTURAL EFFECTS OF MULTIPOLE MOMENTS ON AQUEOUS SOLVATION OF IONS USING THE SOFT-STICKY DIPOLE-QUADRUPOLE-OCTUPOLE WATER MODEL. Chemical Physics Letters. 499: 219-225. PMID 21072252 DOI: 10.1016/J.Cplett.2010.09.043 |
0.412 |
|
| 2010 |
Te JA, Tan ML, Ichiye T. Solvation of Biomolecules by the Soft Sticky Dipole-Quadrupole-Octupole Water Model. Chemical Physics Letters. 486: 70-73. PMID 21031143 DOI: 10.1016/J.Cplett.2009.12.089 |
0.409 |
|
| 2010 |
Perrin BS, Ichiye T. Fold versus sequence effects on the driving force for protein-mediated electron transfer. Proteins. 78: 2798-808. PMID 20635418 DOI: 10.1002/Prot.22794 |
0.428 |
|
| 2010 |
Te JA, Ichiye T. Temperature and pressure dependence of the optimized soft-sticky dipole-quadrupole-octupole water model. The Journal of Chemical Physics. 132: 114511. PMID 20331309 DOI: 10.1063/1.3359432 |
0.383 |
|
| 2010 |
Luo Y, Ergenekan CE, Fischer JT, Tan ML, Ichiye T. The molecular determinants of the increased reduction potential of the rubredoxin domain of rubrerythrin relative to rubredoxin Biophysical Journal. 98: 560-568. PMID 20159152 DOI: 10.1016/J.Bpj.2009.11.006 |
0.74 |
|
| 2009 |
Niu S, Nichols JA, Ichiye T. Optimization of Spin-Unrestricted Density Functional Theory for Redox Properties of Rubredoxin Redox Site Analogues. Journal of Chemical Theory and Computation. 5: 1361-1368. PMID 20161267 DOI: 10.1021/Ct800357C |
0.34 |
|
| 2009 |
Niu S, Ichiye T. Probing ligand effects on the redox energies of [4Fe-4S] clusters using broken-symmetry density functional theory. The Journal of Physical Chemistry. A. 113: 5671-6. PMID 19378988 DOI: 10.1021/Jp809446Q |
0.321 |
|
| 2009 |
Niu S, Ichiye T. Cleavage of [4Fe-4S]-type clusters: breaking the symmetry. The Journal of Physical Chemistry. A. 113: 5710-7. PMID 19378967 DOI: 10.1021/Jp900402Y |
0.316 |
|
| 2009 |
Niu S, Ichiye T. Insight into environmental effects on bonding and redox properties of [4Fe-4S] clusters in proteins. Journal of the American Chemical Society. 131: 5724-5. PMID 19341280 DOI: 10.1021/Ja900406J |
0.364 |
|
| 2008 |
Xiao Y, Tan ML, Ichiye T, Wang H, Guo Y, Smith MC, Meyer J, Sturhahn W, Alp EE, Zhao J, Yoda Y, Cramer SP. Dynamics of Rhodobacter capsulatus [2FE-2S] ferredoxin VI and Aquifex aeolicus ferredoxin 5 via nuclear resonance vibrational spectroscopy (NRVS) and resonance Raman spectroscopy. Biochemistry. 47: 6612-27. PMID 18512953 DOI: 10.1021/Bi701433M |
0.321 |
|
| 2007 |
Niu S, Ichiye T. Probing the structural effects on the intrinsic electronic and redox properties of [2Fe-2S]+ clusters, a broken-symmetry density functional theory study Theoretical Chemistry Accounts. 117: 275-281. DOI: 10.1007/S00214-006-0136-Y |
0.33 |
|
| 2006 |
Chowdhuri S, Tan ML, Ichiye T. Dynamical properties of the soft sticky dipole-quadrupole-octupole water model: a molecular dynamics study. The Journal of Chemical Physics. 125: 144513. PMID 17042615 DOI: 10.1063/1.2357117 |
0.348 |
|
| 2006 |
Tan ML, Lucan L, Ichiye T. Study of multipole contributions to the structure of water around ions in solution using the soft sticky dipole-quadrupole-octupole (SSDQO) model of water. The Journal of Chemical Physics. 124: 174505. PMID 16689581 DOI: 10.1063/1.2177240 |
0.335 |
|
| 2006 |
Ichiye T, Tan ML. Soft sticky dipole-quadrupole-octupole potential energy function for liquid water: an approximate moment expansion. The Journal of Chemical Physics. 124: 134504. PMID 16613458 DOI: 10.1063/1.2161201 |
0.358 |
|
| 2006 |
Tan ML, Kang C, Ichiye T. The role of backbone stability near Ala44 in the high reduction potential class of rubredoxins. Proteins. 62: 708-14. PMID 16362979 DOI: 10.1002/Prot.20806 |
0.382 |
|
| 2006 |
Tan ML, Brooks BR, Ichiye T. Temperature dependence of diffusion properties of soft sticky dipole water Chemical Physics Letters. 421: 166-170. DOI: 10.1016/J.Cplett.2006.01.048 |
0.325 |
|
| 2005 |
Ergenekan CE, Tan ML, Ichiye T. Effects of environment on the structure of Pyrococcus furiosus rubredoxin: a molecular dynamics study. Proteins. 61: 823-8. PMID 16245319 DOI: 10.1002/Prot.20685 |
0.731 |
|
| 2005 |
Fu YJ, Niu S, Ichiye T, Wang LS. Electronic structure and intrinsic redox properties of [2Fe-2S]+ clusters with tri- and tetracoordinate iron sites. Inorganic Chemistry. 44: 1202-4. PMID 15732958 DOI: 10.1021/Ic048559D |
0.326 |
|
| 2004 |
Park IY, Eidsness MK, Lin IJ, Gebel EB, Youn B, Harley JL, Machonkin TE, Frederick RO, Markley JL, Smith ET, Ichiye T, Kang C. Crystallographic studies of V44 mutants of Clostridium pasteurianum rubredoxin: effects of side-chain size on reduction potential. Proteins. 57: 618-25. PMID 15382226 DOI: 10.1002/Prot.20243 |
0.446 |
|
| 2004 |
Park IY, Youn B, Harley JL, Eidsness MK, Smith E, Ichiye T, Kang C. The unique hydrogen bonded water in the reduced form of Clostridium pasteurianum rubredoxin and its possible role in electron transfer. Journal of Biological Inorganic Chemistry : Jbic : a Publication of the Society of Biological Inorganic Chemistry. 9: 423-8. PMID 15067525 DOI: 10.1007/S00775-004-0542-3 |
0.427 |
|
| 2004 |
Dolan EA, Yelle RB, Beck BW, Fischer JT, Ichiye T. Protein Control of Electron Transfer Rates via Polarization: Molecular Dynamics Studies of Rubredoxin Biophysical Journal. 86: 2030-2036. PMID 15041645 |
0.313 |
|
| 2004 |
Tan ML, Dolan EA, Ichiye T. Understanding intramolecular electron transfer in ferredoxin: A molecular dynamics study Journal of Physical Chemistry B. 108: 20435-20441. DOI: 10.1021/Jp046367Y |
0.429 |
|
| 2003 |
Wang XB, Niu S, Yang X, Ibrahim SK, Pickett CJ, Ichiye T, Wang LS. Probing the intrinsic electronic structure of the cubane [4Fe-4S] cluster: nature's favorite cluster for electron transfer and storage. Journal of the American Chemical Society. 125: 14072-81. PMID 14611244 DOI: 10.1021/Ja036831X |
0.37 |
|
| 2003 |
Ergenekan CE, Thomas D, Fischer JT, Tan ML, Eidsness MK, Kang C, Ichiye T. Prediction of reduction potential changes in rubredoxin: a molecular mechanics approach. Biophysical Journal. 85: 2818-29. PMID 14581187 DOI: 10.1016/S0006-3495(03)74705-5 |
0.739 |
|
| 2003 |
Yang X, Wang X, Wang L, Niu S, Ichiye T. On the electronic structures of gaseous transition metal halide complexes, FeX4− and MX3− (M=Mn, Fe, Co, Ni, X=Cl, Br), using photoelectron spectroscopy and density functional calculations The Journal of Chemical Physics. 119: 8311-8320. DOI: 10.1063/1.1610431 |
0.323 |
|
| 2003 |
Niu S, Wang XB, Nichols JA, Wang LS, Ichiye T. Combined quantum chemistry and photoelectron spectroscopy study of the electronic structure and reduction potentials of rubredoxin redox site analogues Journal of Physical Chemistry A. 107: 2898-2907. DOI: 10.1021/Jp034316F |
0.346 |
|
| 2001 |
Min T, Ergenekan CE, Eidsness MK, Ichiye T, Kang C. Leucine 41 is a gate for water entry in the reduction of Clostridium pasteurianum rubredoxin. Protein Science : a Publication of the Protein Society. 10: 613-21. PMID 11344329 DOI: 10.1110/Gad.34501 |
0.751 |
|
| 2000 |
Koerner JB, Ichiye T. Interactions of the Rubredoxin Redox Site Analogue [Fe(SCH3)4]2-with Water: An Ab Initio Quantum Chemistry Study The Journal of Physical Chemistry B. 104: 2424-2431. DOI: 10.1021/Jp9925785 |
0.322 |
|
| 1999 |
Eidsness MK, Burden AE, Richie KA, Kurtz DM, Scott RA, Smith ET, Ichiye T, Beard B, Min T, Kang C. Modulation of the redox potential of the [Fe(SCys)(4)] site in rubredoxin by the orientation of a peptide dipole. Biochemistry. 38: 14803-9. PMID 10555962 DOI: 10.1021/Bi991661F |
0.317 |
|
| 1999 |
Chandra A, Ichiye T. Dynamical properties of the soft sticky dipole model of water: Molecular dynamics simulations Journal of Chemical Physics. 111: 2701-2709. DOI: 10.1063/1.479546 |
0.398 |
|
| 1999 |
Beck BW, Koerner JB, Ichiye T. Ab Initio Quantum Mechanical Study of Metal Substitution in Analogues of Rubredoxin: Implications for Redox Potential Control The Journal of Physical Chemistry B. 103: 8006-8015. DOI: 10.1021/Jp9912814 |
0.351 |
|
| 1998 |
Hyun JK, Ichiye T. Nonlinear response in ionic solvation: A theoretical investigation Journal of Chemical Physics. 109: 1074-1083. DOI: 10.1063/1.476650 |
0.346 |
|
| 1997 |
Swartz PD, Ichiye T. Protein contributions to redox potentials of homologous rubredoxins: An energy minimization study Biophysical Journal. 73: 2733-2741. PMID 9370467 DOI: 10.1016/S0006-3495(97)78302-4 |
0.304 |
|
| 1997 |
Hyun J, Ichiye T. Understanding the Born Radius via Computer Simulations and Theory Journal of Physical Chemistry B. 101: 3596-3604. DOI: 10.1021/Jp9701404 |
0.34 |
|
| 1997 |
and RBY, Ichiye T. Solvation Free Energy Reaction Curves for Electron Transfer in Aqueous Solution: Theory and Simulation Journal of Physical Chemistry B. 101: 4127-4135. DOI: 10.1021/Jp970081U |
0.38 |
|
| 1997 |
Koerner JB, Ichiye T. Conformational Dependence of the Electronic Properties of [Fe(SCH3)4]-,2- The Journal of Physical Chemistry B. 101: 3633-3643. DOI: 10.1021/Jp963897O |
0.393 |
|
| 1996 |
Swartz PD, Beck BW, Ichiye T. Structural origins of redox potentials in fe-s proteins: Electrostatic potentials of crystal structures Biophysical Journal. 71: 2958-2969. PMID 8968568 DOI: 10.1016/S0006-3495(96)79533-4 |
0.441 |
|
| 1996 |
Karplus M, Ichiye T. Comment on a "fluctuation and cross correlation analysis of protein motions observed in nanosecond molecular dynamics simulations". Journal of Molecular Biology. 263: 120-2. PMID 8913294 DOI: 10.1006/Jmbi.1996.0562 |
0.335 |
|
| 1996 |
Swartz PD, Ichiye T. Temperature dependence of the redox potential of rubredoxin from Pyrococcus furiosus: A molecular dynamics study Biochemistry. 35: 13772-13779. PMID 8901519 DOI: 10.1021/Bi960611X |
0.439 |
|
| 1996 |
Ichiye T. Solvent free energy curves for electron transfer reactions: A nonlinear solvent response model Journal of Chemical Physics. 104: 7561-7571. DOI: 10.1063/1.471465 |
0.344 |
|
| 1996 |
Liu Y, Ichiye T. Soft Sticky Dipole Potential for Liquid Water: A New Model The Journal of Physical Chemistry. 100: 2723-2730. DOI: 10.1021/Jp952324T |
0.361 |
|
| 1995 |
Yelle RB, Park NS, Ichiye T. Molecular dynamics simulations of rubredoxin from Clostridium pasteurianum: changes in structure and electrostatic potential during redox reactions. Proteins. 22: 154-67. PMID 7567963 DOI: 10.1002/prot.340220208 |
0.406 |
|
| 1994 |
Shenoy VS, Ichiye T. Influence of protein flexibility on the redox potential of rubredoxin: energy minimization studies. Proteins. 17: 152-60. PMID 8265563 DOI: 10.1002/prot.340170205 |
0.345 |
|
| 1993 |
Yang Y, Beck BW, Shenoy VS, Ichiye T. Aqueous solvation of a rubredoxin redox site analog: a molecular dynamics simulation Journal of the American Chemical Society. 115: 7439-7444. DOI: 10.1021/Ja00069A050 |
0.406 |
|
| 1992 |
Ichiye T, Karplus M. Collective motions in proteins: a covariance analysis of atomic fluctuations in molecular dynamics and normal mode simulations. Proteins. 11: 205-17. PMID 1749773 DOI: 10.1002/Prot.340110305 |
0.384 |
|
| 1990 |
Ichiye T, Haymet ADJ. Integral equation theory of ionic solutions Journal of Chemical Physics. 93: 8954-8962. DOI: 10.1063/1.459234 |
0.305 |
|
| 1988 |
Ichiye T, Karplus M. Anisotropy and anharmonicity of atomic fluctuations in proteins: analysis of a molecular dynamics simulation. Proteins. 2: 236-59. PMID 3447180 DOI: 10.1002/Prot.340020308 |
0.348 |
|
| 1988 |
Ichiye T, Karplus M. Anisotropy and anharmonicity of atomic fluctuations in proteins: implications for X-ray analysis. Biochemistry. 27: 3487-97. PMID 3390447 DOI: 10.1021/Bi00409A054 |
0.337 |
|
| 1988 |
Ichiye T, Haymet ADJ. Accurate integral equation theory for the central force model of liquid water and ionic solutions The Journal of Chemical Physics. 89: 4315-4324. DOI: 10.1063/1.454815 |
0.32 |
|
| 1987 |
Karplus M, Ichiye T, Pettitt BM. Configurational entropy of native proteins. Biophysical Journal. 52: 1083-5. PMID 3427197 DOI: 10.1016/S0006-3495(87)83303-9 |
0.372 |
|
| 1986 |
Ichiye T, Olafson BD, Swaminathan S, Karplus M. Structure and internal mobility of proteins: a molecular dynamics study of hen egg white lysozyme. Biopolymers. 25: 1909-37. PMID 3779015 DOI: 10.1002/Bip.360251008 |
0.478 |
|
| 1983 |
Ichiye T, Karplus M. Fluorescence depolarization of tryptophan residues in proteins: a molecular dynamics study. Biochemistry. 22: 2884-93. PMID 6871168 DOI: 10.1021/Bi00281A017 |
0.337 |
|
| 1981 |
Herzfeld J, Ichiye T, Jung D. Molecular symmetry and metastable states of enzymes exhibiting half-of-the-sites reactivity. Biochemistry. 20: 4936-41. PMID 7028097 DOI: 10.1021/Bi00520A020 |
0.308 |
|
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