Sentence examples for structural restraints from inspiring English sources

A summary of structural restraints used in the structure calculation and statistics for the structure ensemble is listed in Table S1.

Structural restraints were collected for structure determination of the SLIds2/SLV complex.

Initial rounds of structure calculations used as many unambiguous structural restraints as possible and were performed with dynamic models that allowed each rotatable bond to adopt three different mean angles of any value, each with attendant floating libration amplitudes (i.e., tri-modal behaviors of unspecified geometries).

We performed a series of molecular dynamics simulations in which Φ and Ψ values were used as ensemble-averaged structural restraints to determine an ensemble of structures representing the TS of ubiquitin.

The search of a gaseous protein for minimum energy structures requires exploring all possible electrostatic interactions without structural restraints from hydrophobic bonding, which can slow the folding process to the extent that transient rather than stable structures may be probed in gas phase experiments on ms timescales.

In total, 309 experimental structural restraints were used to define the dynamic 3D-structure of streptomycin (Table 1; see Supplementary Tables S9-S12 for details), comprising nuclear Overhauser enhancements (NOEs), scalar couplings and residual dipolar couplings.

Different from this definition of conventional block sparsity, the multi-linear block sparsity considers mainly the addition to the multi-linear structural restraint as interpreted in Definition 1.

The lunar surface gloves consisted of integral structural restraint and pressure bladders, molded from casts of the crewmen's hands, and covered by multilayered superinsulation for thermal and abrasion protection.

This structural restraint was highlighted by the peptide-bound PRMT5·MEP50 complex, which revealed the presence of a characteristic β-turn in the peptide substrate.

For each coupling constant a suitable Karplus relation (typically an incarnation of the Altona–Hasnoot equation ) for the torsion in question was associated with the raw measurement to produce a structural restraint.

The structural restraint file for IP6 was generated using REEL in PHENIX (Adams et al., 2002) based on the conformation of IP6 seen in the structure of Auxin receptor TIR1 (PDB: 2P1P) (Tan et al., 2007).