Matches in SemOpenAlex for { <https://semopenalex.org/work/W1572000980> ?p ?o ?g. }
Showing items 1 to 95 of
95
with 100 items per page.
- W1572000980 endingPage "281" @default.
- W1572000980 startingPage "259" @default.
- W1572000980 abstract "A reappraisal has been made of interatomic potential functions for protein structure calculations using the all-atom approximation (except CH, CH2 and CH3, which are treated as “united atoms”). Some key problems are identified and treated. The potential functions are somewhat novel in form and consistent with more efficient and robust folding algorithms. In addition, the potentials are calibrated for the rigid geometry approximation, since use of fixed standard bond lengths and valence angles (and fixed trans planar peptide groups) reduces the number of conformational variables and saves a great deal of computer time. Though these algorithms demand the use of potential functions of this special type, these functions can be readily implemented in more classical programs for the conformational analysis of proteins. They are calibrated or tested against a large body of experimental data, including (1) extended basis set ab initio, quantum mechanical calculations, (2) nuclear magnetic resonance spectroscopic data and dipole moment data for di- and oligopeptides, (3) characteristic ratio data for random coil homopolypeptides, (4) extensive data from peptide solubility studies, and (5) experimental structures of polyalanine fibres and globular proteins. This paper will form the basis of a further report, which will include investigations of how water might be more realistically represented subject to the computing power available." @default.
- W1572000980 created "2016-06-24" @default.
- W1572000980 creator A5009453283 @default.
- W1572000980 creator A5011531635 @default.
- W1572000980 date "1986-03-01" @default.
- W1572000980 modified "2023-10-14" @default.
- W1572000980 title "Refined models for computer calculations in protein engineering" @default.
- W1572000980 cites W1247114292 @default.
- W1572000980 cites W1505391157 @default.
- W1572000980 cites W1526480265 @default.
- W1572000980 cites W1588000118 @default.
- W1572000980 cites W1605897306 @default.
- W1572000980 cites W1650728208 @default.
- W1572000980 cites W1964673837 @default.
- W1572000980 cites W1965838279 @default.
- W1572000980 cites W1966041739 @default.
- W1572000980 cites W1983119218 @default.
- W1572000980 cites W1984099313 @default.
- W1572000980 cites W2008708467 @default.
- W1572000980 cites W2019521315 @default.
- W1572000980 cites W2031178887 @default.
- W1572000980 cites W2039388179 @default.
- W1572000980 cites W2045529563 @default.
- W1572000980 cites W2060130346 @default.
- W1572000980 cites W2062340785 @default.
- W1572000980 cites W2066233848 @default.
- W1572000980 cites W2079589162 @default.
- W1572000980 cites W2082263198 @default.
- W1572000980 cites W2084461944 @default.
- W1572000980 cites W2089052645 @default.
- W1572000980 cites W2092670767 @default.
- W1572000980 cites W2103640565 @default.
- W1572000980 cites W2169522742 @default.
- W1572000980 cites W2171074980 @default.
- W1572000980 cites W2306955865 @default.
- W1572000980 cites W2317136561 @default.
- W1572000980 cites W2327367321 @default.
- W1572000980 cites W2334211226 @default.
- W1572000980 cites W2340561309 @default.
- W1572000980 cites W3004632570 @default.
- W1572000980 doi "https://doi.org/10.1016/0022-2836(86)90309-8" @default.
- W1572000980 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/3755181" @default.
- W1572000980 hasPublicationYear "1986" @default.
- W1572000980 type Work @default.
- W1572000980 sameAs 1572000980 @default.
- W1572000980 citedByCount "52" @default.
- W1572000980 crossrefType "journal-article" @default.
- W1572000980 hasAuthorship W1572000980A5009453283 @default.
- W1572000980 hasAuthorship W1572000980A5011531635 @default.
- W1572000980 hasConcept C105168689 @default.
- W1572000980 hasConcept C11413529 @default.
- W1572000980 hasConcept C121332964 @default.
- W1572000980 hasConcept C121864883 @default.
- W1572000980 hasConcept C147597530 @default.
- W1572000980 hasConcept C173523689 @default.
- W1572000980 hasConcept C185592680 @default.
- W1572000980 hasConcept C2781442258 @default.
- W1572000980 hasConcept C41008148 @default.
- W1572000980 hasConcept C62520636 @default.
- W1572000980 hasConcept C8010536 @default.
- W1572000980 hasConcept C84114770 @default.
- W1572000980 hasConceptScore W1572000980C105168689 @default.
- W1572000980 hasConceptScore W1572000980C11413529 @default.
- W1572000980 hasConceptScore W1572000980C121332964 @default.
- W1572000980 hasConceptScore W1572000980C121864883 @default.
- W1572000980 hasConceptScore W1572000980C147597530 @default.
- W1572000980 hasConceptScore W1572000980C173523689 @default.
- W1572000980 hasConceptScore W1572000980C185592680 @default.
- W1572000980 hasConceptScore W1572000980C2781442258 @default.
- W1572000980 hasConceptScore W1572000980C41008148 @default.
- W1572000980 hasConceptScore W1572000980C62520636 @default.
- W1572000980 hasConceptScore W1572000980C8010536 @default.
- W1572000980 hasConceptScore W1572000980C84114770 @default.
- W1572000980 hasIssue "2" @default.
- W1572000980 hasLocation W15720009801 @default.
- W1572000980 hasLocation W15720009802 @default.
- W1572000980 hasOpenAccess W1572000980 @default.
- W1572000980 hasPrimaryLocation W15720009801 @default.
- W1572000980 hasRelatedWork W1514629162 @default.
- W1572000980 hasRelatedWork W2027608803 @default.
- W1572000980 hasRelatedWork W2030918907 @default.
- W1572000980 hasRelatedWork W2072157275 @default.
- W1572000980 hasRelatedWork W2748952813 @default.
- W1572000980 hasRelatedWork W2899084033 @default.
- W1572000980 hasRelatedWork W2951763691 @default.
- W1572000980 hasRelatedWork W2987655055 @default.
- W1572000980 hasRelatedWork W3012763872 @default.
- W1572000980 hasRelatedWork W4300514628 @default.
- W1572000980 hasVolume "188" @default.
- W1572000980 isParatext "false" @default.
- W1572000980 isRetracted "false" @default.
- W1572000980 magId "1572000980" @default.
- W1572000980 workType "article" @default.