Sentence examples for because of experimental restraints from inspiring English sources

Although it is difficult to distinguish clusters because of experimental restraints, we observed that the lowest energy structures, as evaluated by the MOE scoring function, all of them belonged to cluster 1. 1BEI and 1ROO were neurotoxins within the cluster 1, in which a major similarity was observed between them.

R osetta allows incorporation of many types of experimental restraints.

The resulting 20 lowest-energy structures of SLVIMg (Table 3) are compatible with all of the experimental restraints, indicating that the new Mg2+ RNA restraints are fully consistent with distance, dihedral, and RDC restraints defined for structure determination of the SLVIfree RNA.

Thus, these two approaches are complementary, and together they provide a large number of nonredundant experimental restraints to define precisely metal-ion binding in the SLVI RNA.

RDCs of both glucosamine rings (A and C) of I were used as experimental restraints.

A family of structures consistent with the experimental restraints was calculated using the programs CYANA [ 38] and CNS [ 39].

Future studies will focus on verifying which disease mutations are indeed destabilizing as well as providing experimental restraints for refinement of this computational model.

With only one CXMS restraint, for example from PP2Ac Lys35 to IGBP1 Lys163, the modeling still afforded a set of CXMS models that are similar to those calculated with the full set of experimental CXMS restraints (Fig. S1B).

The calculated ensemble of structures is of high precision and is in excellent agreement with the experimental restraints.

These experimental restraints are summarized in Table S1 of the Supporting Information.

The fit to experimental restraints is evaluated from the number of violated distance restraints and the RMS of violations, a restraint being violated if the distance is larger than U +0.5 Å or smaller than L −0.5 Å, where U and L are restraint upper and lower bounds.