The phrase "a set of reference conformers" is correct and usable in written English.
It can be used in scientific or technical contexts, particularly in fields like chemistry or molecular biology, where conformers refer to different spatial arrangements of a molecule.
Example: "In our study, we analyzed a set of reference conformers to determine the most stable configuration of the compound."
Alternatives: "a collection of reference conformers" or "a group of reference conformers".
A set of reference data and molecules.
We selected a set of 26 conformers of Calmodulin derived from NMR-experiments (PDB entry 1CFF) and each one of the 26 models was submitted to the Rd.HMM protocol to generate a set of 150 variants per model.
C Conformer Multiple conformer, All-conformer-pair approach Similarity scores that one may expect when a single "query" conformer is compared to a set of multiple diverse conformers of the "database" compounds, using the "all-conformer-pair" approach.
D Conformer Multiple conformer, Best-conformer-pair approach Similarity scores that one may expect when a single "query" conformer is compared to a set of multiple diverse conformers of the "database" compounds using the "best-conformer-pair" approach.
E Compound Multiple conformer, Best-conformer-pair approach Similarity scores that one may expect when each "query" conformer is compared to a set of multiple diverse conformers of the "database" compounds using the "best-conformer-pair" approach.
B Compound Multiple conformer, All-conformer-pair approach Similarity scores that one may expect when each "query" conformer is compared to a set of multiple diverse conformers of the "database" compounds, using the "all-conformer-pair" approach.
The pharmacophore program must allow the import of a set of pre-generated conformers that are pre-aligned to the pharmacophore model.
Each rotatable bond was assigned a set of conformer modes, or in statistical thermodynamic terms, macrostates ; each macrostate comprising a mean torsional angle, a spread and a probability.
After finding a suitable set of reference shapes, the CPU cost to search for similar conformers across datasets of millions can be dramatically reduced.
Because we aim at selecting a diverse set of shapes, the reference conformers appear to represent particular structural features to a greater extent than are present in the entire dataset.
