검색결과 : 90건
| No. | Article |
|---|---|
| 1 |
PMFF: Development of a Physics-Based Molecular Force Field for Protein Simulation and Ligand Docking Hwang SB, Lee CJ, Lee S, Ma SL, Kang YM, Cho KH, Kim SY, Kwon OY, Yoon CN, Kang YK, Yoon JH, Nam KY, Kim SG, In Y, Chai HH, Acree WE, Grant JA, Gibson KD, Jhon MS, Scheraga HA, No KT Journal of Physical Chemistry B, 124(6), 974, 2020 |
| 2 |
Curvature and Torsion of Protein Main Chain as Local Order Parameters of Protein Unfolding Grassein P, Delarue P, Nicolai A, Neiers F, Scheraga HA, Maisuradze GG, Senet P Journal of Physical Chemistry B, 124(22), 4391, 2020 |
| 3 |
New Insights into Folding, Misfolding, and Nonfolding Dynamics of a WW Domain Kachlishvili K, Korneev A, Maisuradze L, Liu J, Scheraga HA, Molochkov A, Senet P, Niemi AJ, Maisuradze GG Journal of Physical Chemistry B, 124(19), 3855, 2020 |
| 4 |
Assessing the One-Bond C-alpha-H Spin-Spin Coupling Constants in Proteins: Pros and Cons of Different Approaches Arroyuelo A, Martin OA, Scheraga HA, Vila JA Journal of Physical Chemistry B, 124(5), 735, 2020 |
| 5 |
Statistical Model To Decipher Protein Folding/Unfolding at a Local Scale Grassein P, Delarue P, Scheraga HA, Maisuradze GG, Senet P Journal of Physical Chemistry B, 122(13), 3540, 2018 |
| 6 |
Dependence of the Formation of Tau and A beta Peptide Mixed Aggregates on the Secondary Structure of the N-Terminal Region of A beta Rojas AV, Maisuradze GG, Scheraga HA Journal of Physical Chemistry B, 122(28), 7049, 2018 |
| 7 |
Simple Physics-Based Analytical Formulas for the Potentials of Mean Force of the Interaction of Amino Acid Side Chains in Water. VII. Charged-Hydrophobic/Polar and Polar-Hydrophobic/Polar Side Chains Makowski M, Liwo A, Scheraga HA Journal of Physical Chemistry B, 121(2), 379, 2017 |
| 8 |
Eliminating a Protein Folding Intermediate by Tuning a Local Hydrophobic Contact Kachlishvili K, Dave K, Gruebele M, Scheraga HA, Maisuradze GG Journal of Physical Chemistry B, 121(15), 3276, 2017 |
| 9 |
Theoretical Studies of Interactions between O-Phosphorylated and Standard Amino-Acid Side-Chain Models in Water Wisniewska M, Sobolewski E, Oldziej S, Liwo A, Scheraga HA, Makowski M Journal of Physical Chemistry B, 119(27), 8526, 2015 |
| 10 |
Tracking the Mechanism of Fibril Assembly by Simulated Two-Dimensional Ultraviolet Spectroscopy Lam AR, Rodriguez JJ, Rojas A, Scheraga HA, Mukamel S Journal of Physical Chemistry A, 117(2), 342, 2013 |