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Scaled second-order perturbation corrections to configuration interaction singles: efficient and reliable excitation energy methodsAn improved algorithm for analytical gradient evaluation in resolution-of-the-identity second-order Møller-Plesset perturbation theory: Application to alanine tetrapeptide conformational analysisOn the pH dependent behavior of the firefly bioluminescence: protein dynamics and water content in the active pocket.Simulations of the role of water in the protein-folding mechanism.Atomistic protein folding simulations on the submillisecond time scale using worldwide distributed computing.Insights into nucleic acid conformational dynamics from massively parallel stochastic simulationsDoes water play a structural role in the folding of small nucleic acids?Dimerization of the p53 oligomerization domain: identification of a folding nucleus by molecular dynamics simulations.How well can simulation predict protein folding kinetics and thermodynamics?Advances in methods and algorithms in a modern quantum chemistry program package.Charged polycyclic aromatic hydrocarbon clusters and the galactic extended red emission.(DNS)C: a fluorescent, environmentally sensitive cytidine derivative for the direct detection of GGG triad sequences.Characterization of vinylgold intermediates: gold-mediated cyclization of acetylenic amides.Electric Field Keeps Chromophore Planar and Produces High Yield Fluorescence in GFP.Emission shaping in fluorescent proteins: role of electrostatics and π-stacking.Poly-cyclodextrin and poly-paclitaxel nano-assembly for anticancer therapy.Kinetic definition of protein folding transition state ensembles and reaction coordinatesTowards the realization of ab initio dynamics at the speed of molecular mechanics: simulations with interpolated diabatic Hamiltonian.Improving long time behavior of Poisson bracket mapping equation: a non-Hamiltonian approach.Constructing an Interpolated Potential Energy Surface of a Large Molecule: A Case Study with Bacteriochlorophyll a Model in the Fenna-Matthews-Olson Complex.Simple Method for Simulating the Mixture of Atomistic and Coarse-Grained Molecular Systems.Dispersion-oriented soft interaction in a frustrated Lewis pair and the entropic encouragement effect in its formation.Performance of quasi-degenerate scaled opposite spin perturbation corrections to single excitation configuration interaction for excited state structures and excitation energies with application to the Stokes shift of 9-methyl-9,10-dihydro-9-silapheOne-dimensional reaction coordinate and the corresponding potential of mean force from commitment probability distribution.Fluorescent peptide indicator displacement assay for monitoring interactions between RNA and RNA binding proteins.Molecule-specific determination of atomic polarizabilities with the polarizable atomic multipole model.Quasidegenerate scaled opposite spin second order perturbation corrections to single excitation configuration interaction.Quartic-Scaling Analytical Gradient of Quasidegenerate Scaled Opposite Spin Second-Order Perturbation Corrections to Single Excitation Configuration Interaction.Solvent viscosity dependence of the protein folding dynamics.A delicate electronic balance between metal and ligand in [Cu-P-Cu-P] diamondoids: oxidation state dependent plasticity and the formation of a singlet diradicaloid.A structural remedy toward bright dipolar fluorophores in aqueous media.Does native state topology determine the RNA folding mechanism?Excited state energy fluctuations in the Fenna-Matthews-Olson complex from molecular dynamics simulations with interpolated chromophore potentials.Diabatic Population Matrix Formalism for Performing Molecular Mechanics Style Simulations with Multiple Electronic States.Interpolated mechanics-molecular mechanics study of internal rotation dynamics of the chromophore unit in blue fluorescent protein and its variants.Constructing polyatomic potential energy surfaces by interpolating diabatic Hamiltonian matrices with demonstration on green fluorescent protein chromophore.Coherent intermolecular proton transfer in the acid-base reaction of excited state pyranine.On surface hopping and time-reversal.Improving long time behavior of Poisson bracket mapping equation: a mapping variable scaling approach.How Does Solvation Affect the Binding of Hydrophilic Amino Saccharides to Cucurbit[7]uril with Exceptional Anomeric Selectivity?
P50
Q28303601-8C143ED6-1401-44B1-96FA-C8602408D8BAQ29307367-12C8A150-04F2-4255-8C23-AB8BA900EE7BQ30431796-EA72D385-3428-4353-8408-E8538EA99255Q33694936-259D32B8-89B5-4E8B-A49D-6E6DA30389FBQ34176555-161CDD30-29FC-47D0-B8F3-49EEDE155AE9Q34182229-84A38955-C9BD-46EE-BAA3-8D58AE04F426Q34189702-B5A027D4-D516-4AB0-BAD0-696E8CDE66B0Q34374840-7C96400D-0E4F-483B-9D9D-E5CD53FC4748Q34415717-E25DB299-1E5A-4435-8DBB-1D628EA224F3Q34556469-A610F024-274A-4A12-8B83-2DAAB6B7CFF9Q35720388-1372C8AA-71A3-4FFB-9401-742F0CD40AECQ38448766-C580377D-2C20-4763-91B5-2DA72865C11CQ38468173-EE7F4B45-1102-40E6-BFB6-64F0F143ACC8Q38818313-94EE20D5-99E1-44D8-9888-2E5EFC9341E5Q38920436-AACEA814-9E8B-4ECE-AD2B-96709F668328Q38997446-0C2C1F40-9BB8-44A4-880D-FF1227C6A2B2Q39133279-E16F41AD-7BB0-4455-BA46-A1E44B4978B7Q39150462-BE30D4F8-992E-4342-888B-B9F11E6DB961Q39191823-59FA250E-43B2-474C-8F75-E954E5A1CBDFQ39270560-B3CCCE47-2FA3-41BB-9850-D1920F710680Q39369732-3B69A8FA-3A18-47ED-A9F8-EBA74E1702A0Q43240710-9127A2C8-5C71-45AB-9CDF-672D226F8ADBQ43279705-636ECA7D-85E2-4A0E-BF34-7DAF12D0840AQ44210843-93A35ED7-D9B1-4063-BE95-4ACEA212591CQ44774569-3AF72102-7561-4463-A3DE-D4C553B9327FQ46037500-5418ADD6-B887-45E7-AE7C-CD5274A4F328Q46333267-69A16E4E-71D3-4DA5-9169-7EDDE4B9BF46Q46501042-2F6F529B-F2AD-4C9C-836B-407BDB051904Q46560363-41CED1F3-63DF-4A10-9990-723B41D65D27Q46669681-C062FA76-CA35-4CEA-95B3-D3892166B295Q47130181-44393988-2655-4A2A-9903-70A40BE1D01EQ47919478-487A2BB9-D831-452D-9C52-35706E0A837CQ49551029-DF947289-80BB-4119-A037-299ADC0FEE2EQ50238965-64CB174C-B66A-4B0B-ACC0-C0FB47D61CBEQ50242839-69601829-6D31-4882-AD97-55E863638300Q50457004-F2A169AF-22F9-411F-8C99-46CBFC6263FEQ50538891-22594816-351F-48FA-AD3B-476B50B7D577Q50967201-DF372747-077D-4956-99D5-0BBA50436E70Q51030459-73BB9FF1-4028-45B3-A048-DBCC39F9A111Q52876728-68A461F9-C855-400B-9F33-601FBDD043DC
P50
description
hulumtues
@sq
onderzoeker
@nl
researcher
@en
հետազոտող
@hy
name
Young Min Rhee
@ast
Young Min Rhee
@en
Young Min Rhee
@es
Young Min Rhee
@nl
Young Min Rhee
@sl
type
label
Young Min Rhee
@ast
Young Min Rhee
@en
Young Min Rhee
@es
Young Min Rhee
@nl
Young Min Rhee
@sl
altLabel
Young Min Rhee
@en
prefLabel
Young Min Rhee
@ast
Young Min Rhee
@en
Young Min Rhee
@es
Young Min Rhee
@nl
Young Min Rhee
@sl
P1053
E-9940-2012
P106
P21
P31
P3829
P496
0000-0002-2392-3962
P569
2000-01-01T00:00:00Z