Matches in SemOpenAlex for { <https://semopenalex.org/work/W1623260030> ?p ?o ?g. }
Showing items 1 to 82 of
82
with 100 items per page.
- W1623260030 endingPage "1708" @default.
- W1623260030 startingPage "1705" @default.
- W1623260030 abstract "Geometric manipulation of molecules is an essential elementary component in computational modeling programs for molecular structure, stability, dynamics, and design. The computational complexity of transformation of internal coordinates to Cartesian coordinates was discussed before.1 The use of rotation matrices was found to be slightly more efficient than that of quaternion although quaternion operators have been widely advertised for rotational operations, especially in molecular dynamics simulations of liquids where the orientation is a dynamical variable.2 The discussion on computational efficiency is extended here to a more general case in which bond angles and sidechain torsion angles are allowed to vary. The algorithm of Thompson3 is derived again in terms of quaternions as well as rotation matrices, and an algorithm with optimal efficiency is described. The algorithm based on rotation matrices is again found to be slightly more efficient than that based on quaternions." @default.
- W1623260030 created "2016-06-24" @default.
- W1623260030 creator A5003116915 @default.
- W1623260030 creator A5076012363 @default.
- W1623260030 date "2007-10-20" @default.
- W1623260030 modified "2023-09-27" @default.
- W1623260030 title "Efficiency of Rotational Operators for Geometric Manipulation of Chain Molecules" @default.
- W1623260030 cites W2007155332 @default.
- W1623260030 cites W2041206603 @default.
- W1623260030 cites W2079572802 @default.
- W1623260030 cites W2124745044 @default.
- W1623260030 cites W2128175348 @default.
- W1623260030 cites W2137604324 @default.
- W1623260030 cites W2156651353 @default.
- W1623260030 doi "https://doi.org/10.5012/bkcs.2007.28.10.1705" @default.
- W1623260030 hasPublicationYear "2007" @default.
- W1623260030 type Work @default.
- W1623260030 sameAs 1623260030 @default.
- W1623260030 citedByCount "4" @default.
- W1623260030 countsByYear W16232600302012 @default.
- W1623260030 countsByYear W16232600302015 @default.
- W1623260030 countsByYear W16232600302018 @default.
- W1623260030 crossrefType "journal-article" @default.
- W1623260030 hasAuthorship W1623260030A5003116915 @default.
- W1623260030 hasAuthorship W1623260030A5076012363 @default.
- W1623260030 hasBestOaLocation W16232600301 @default.
- W1623260030 hasConcept C11413529 @default.
- W1623260030 hasConcept C121332964 @default.
- W1623260030 hasConcept C141071460 @default.
- W1623260030 hasConcept C147597530 @default.
- W1623260030 hasConcept C16038011 @default.
- W1623260030 hasConcept C16345878 @default.
- W1623260030 hasConcept C185592680 @default.
- W1623260030 hasConcept C200127275 @default.
- W1623260030 hasConcept C2524010 @default.
- W1623260030 hasConcept C33923547 @default.
- W1623260030 hasConcept C59593255 @default.
- W1623260030 hasConcept C6342182 @default.
- W1623260030 hasConcept C71924100 @default.
- W1623260030 hasConcept C74050887 @default.
- W1623260030 hasConcept C74650414 @default.
- W1623260030 hasConcept C77461463 @default.
- W1623260030 hasConcept C83633838 @default.
- W1623260030 hasConceptScore W1623260030C11413529 @default.
- W1623260030 hasConceptScore W1623260030C121332964 @default.
- W1623260030 hasConceptScore W1623260030C141071460 @default.
- W1623260030 hasConceptScore W1623260030C147597530 @default.
- W1623260030 hasConceptScore W1623260030C16038011 @default.
- W1623260030 hasConceptScore W1623260030C16345878 @default.
- W1623260030 hasConceptScore W1623260030C185592680 @default.
- W1623260030 hasConceptScore W1623260030C200127275 @default.
- W1623260030 hasConceptScore W1623260030C2524010 @default.
- W1623260030 hasConceptScore W1623260030C33923547 @default.
- W1623260030 hasConceptScore W1623260030C59593255 @default.
- W1623260030 hasConceptScore W1623260030C6342182 @default.
- W1623260030 hasConceptScore W1623260030C71924100 @default.
- W1623260030 hasConceptScore W1623260030C74050887 @default.
- W1623260030 hasConceptScore W1623260030C74650414 @default.
- W1623260030 hasConceptScore W1623260030C77461463 @default.
- W1623260030 hasConceptScore W1623260030C83633838 @default.
- W1623260030 hasIssue "10" @default.
- W1623260030 hasLocation W16232600301 @default.
- W1623260030 hasLocation W16232600302 @default.
- W1623260030 hasOpenAccess W1623260030 @default.
- W1623260030 hasPrimaryLocation W16232600301 @default.
- W1623260030 hasRelatedWork W2045739440 @default.
- W1623260030 hasRelatedWork W2076146791 @default.
- W1623260030 hasRelatedWork W2091132606 @default.
- W1623260030 hasRelatedWork W2216054898 @default.
- W1623260030 hasRelatedWork W2330321821 @default.
- W1623260030 hasRelatedWork W2360900418 @default.
- W1623260030 hasRelatedWork W2376786248 @default.
- W1623260030 hasRelatedWork W2381584688 @default.
- W1623260030 hasRelatedWork W2891685443 @default.
- W1623260030 hasRelatedWork W2948202761 @default.
- W1623260030 hasVolume "28" @default.
- W1623260030 isParatext "false" @default.
- W1623260030 isRetracted "false" @default.
- W1623260030 magId "1623260030" @default.
- W1623260030 workType "article" @default.