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The effect is due to the improved accessibility of active sites and easier transport of bulky molecules provided by mesopores.
This effect is due to the improved accessibility of active sites and easier transport of bulky molecules provided by mesopores, on the one hand, and optimal zeolitic acidity, on the other hand.
The Dice and Tanimoto were found to give very similar results [50], which is expected given that the ranking of molecules provided by the two methods is provable to be exactly the same (see Appendix).
Most "experimental" 3-D coordinates for small molecules provided by the PDB are, in essence, theoretical models derived from fitting electron density produced by X-ray diffraction experiments to the presumed location of atoms that are part of a protein, a ligand (typically bound to the protein), and other moieties (ions, water molecules, etc).
Ligand molecules provided by DUD were already assigned with the atom's partial charges.
Because we were only interested in PPI, we omitted interactions involving non-protein molecules provided by BIND.
Similar(49)
Roseobacticides are biosynthesized from the algal growth promoter, the major food molecule provided by the algal cells, and the algal senescence signal that initiates the mutualist-to-parasite switch.
The stabilization energy of a CO molecule provided by the 51264 cage is determined to be ~65% of the total interaction energy of the CO molecule, indicating that the molecules in the adjacent cages contribute 35% of the interaction energy for CO molecules in the doubly occupied cages.
This work was based on chemical information about base composition of the molecule provided by Erwin Chargaff, on data from X-ray crystallography produced by Rosalind Franklin and Maurice Wilkins, and on mechanical model building as developed by Linus Pauling.
However, the optimal activation of a T lymphocyte requires a second signal provided by co-stimulatory molecules, which are normally balanced with inhibitory molecules [ 14].
Direct evidence for the presence and composition of surface-bound linker molecules is provided by LDI mass spectrometry and by quantitative XPS analysis of trifluoroacetylated derivatives.
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