about
QM/MM molecular dynamics study of the galactopyranose → galactofuranose reaction catalysed by Trypanosoma cruzi UDP-galactopyranose mutase.Consistent Principal Component Modes from Molecular Dynamics Simulations of Proteins.Communication: Mode specific quantum dynamics of the F + CHD3 → HF + CD3 reaction.Free-energy computations identify the mutations required to confer trans-sialidase activity into Trypanosoma rangeli sialidase.Non-adiabatic effects in F + CHD3 reactive scattering.Vibrational dynamics of the CH4·F- complex.Resonances in the entrance channel of the elementary chemical reaction of fluorine and methane.Molecular Dynamics Study of the Active Site of Methylamine DehydrogenaseQuantum study of the structure of the active site of methylamine dehydrogenaseRate Constants for the CH4+ H → CH3+ H2Reaction Calculated with a Generalized Reduced-Dimensionality Method†Quantum scattering and quasi-classical trajectory calculations for the H2+OH ⇌ H2O+H reaction on a new potential surfaceA Quasiclassical Study of the F(2P) + CHD3 (ν1 = 0,1) Reactive System on an Accurate Potential Energy SurfaceA full-dimensional wave packet dynamics study of the photodetachment spectra of FCH 4−Molecular Dynamics Simulations of Substrate Release from Trypanosoma cruzi UDP-Galactopyranose MutaseRate constants calculation with a simple mixed quantum/classical implementation of the flux-flux correlation function methodNew insights into the meaning and usefulness of principal component analysis of concatenated trajectoriesCharge Discrimination in P2X4 Receptors Occurs in Two Consecutive StagesPositively Charged Residues in the Head Domain of P2X4 Receptors Assist the Binding of ATPA Quasi-Classical Evaluation of the J-Shifting Approximation for the Reactive Cross Sections of F + CHD3 and F + CH4
P50
Q35315473-8017E023-D030-4E1E-92FE-0992A79F3318Q38903454-0022633E-77BD-4F59-B63A-759F129AEE02Q39786285-80853AAA-145E-40CD-AD88-7B6B1D9B386EQ44480412-36D06CED-9ACF-4937-8651-A278926A747BQ47810252-427853AC-1977-4334-820C-9CED0EE914DCQ47979264-7844256D-977A-4798-8DB6-3B22EC234FB5Q54487928-6FB23029-5E1D-4AB7-9C86-EF89C1EB641AQ60167437-2DF6367F-9A98-4C40-A02D-0531635A7FF5Q60167438-0DE6637D-076D-4F9C-AD46-A4FA265D246CQ60167443-6319F51D-BE41-4C0E-9C6C-3828EAC4A4B0Q60167450-293EE484-C9E6-497E-B5FA-1BDE5C0F7A3BQ62043959-27022634-A908-4C65-97CB-D90D1F6EE5ADQ62043970-0242D350-AC98-410B-AB89-AA021DF0940CQ64286617-B532F607-B8FE-4DEA-A5C2-A89827ED7E11Q83588207-C6CF4F08-3E90-4C57-A64A-E99EC41A0ADAQ86314201-8DC41FD5-ADE2-4972-B479-FABAAA32DD8CQ90961975-0922B2B0-1B17-4378-B049-02A154018DD5Q91355679-C77B6905-B645-4962-89C3-73E00238F1ECQ92283329-F6D73C29-1654-44C4-AF8B-5B429F97C7B5
P50
description
hulumtuese
@sq
researcher
@en
wetenschapper
@nl
հետազոտող
@hy
name
Juliana Palma
@ast
Juliana Palma
@en
Juliana Palma
@es
Juliana Palma
@nl
type
label
Juliana Palma
@ast
Juliana Palma
@en
Juliana Palma
@es
Juliana Palma
@nl
prefLabel
Juliana Palma
@ast
Juliana Palma
@en
Juliana Palma
@es
Juliana Palma
@nl
P106
P21
P31
P496
0000-0002-0761-0253