AtomDiagramCoordinates
AtomDiagramCoordinates
Moleculeおよび関連関数のオプションで，原子の二次元座標を指定する．
詳細
- AtomDiagramCoordinates->Automaticは，必要なときに座標を計算するように指定する．
- AtomDiagramCoordinates->pts は pts を使って原子を置く．
- MoleculeValue[mol,"AtomDiagramCoordinates"]を使って分子 mol の2D座標を取り出す．
例題
例 (2)
Molecule[{"F", "C", "I", "Br", "Cl"}, {Bond[{1, 2}, "Single"], Bond[{2, 3}, "Single"], Bond[{2, 4}, "Single"], Bond[{2, 5}, "Single"]}, StereochemistryElements -> {2 -> "R"}, AtomDiagramCoordinates -> {{-0.87, -0.64}, {0., -0.15}, {0.5, 0.72}, {-0.5, 0.72}, {0.86, -0.65}}]MoleculeValueを使って座標を取り出す：
MoleculeValue[%, "AtomDiagramCoordinates"]Molecule[{"F", "C", "I", "Br", "Cl"}, {Bond[{1, 2}, "Single"], Bond[{2, 3}, "Single"], Bond[{2, 4}, "Single"], Bond[{2, 5}, "Single"]}, StereochemistryElements -> {2 -> "R"}, AtomDiagramCoordinates -> Automatic]MoleculeValueを使って座標を取り出す：
MoleculeValue[%, "AtomDiagramCoordinates"]
Wolfram Research (2019), AtomDiagramCoordinates, Wolfram言語関数， https://reference.wolfram.com/language/ref/AtomDiagramCoordinates.html.
テキスト
Wolfram Research (2019), AtomDiagramCoordinates, Wolfram言語関数， https://reference.wolfram.com/language/ref/AtomDiagramCoordinates.html.
CMS
Wolfram Language. 2019. "AtomDiagramCoordinates." Wolfram Language & System Documentation Center. Wolfram Research. https://reference.wolfram.com/language/ref/AtomDiagramCoordinates.html.
APA
Wolfram Language. (2019). AtomDiagramCoordinates. Wolfram Language & System Documentation Center. Retrieved from https://reference.wolfram.com/language/ref/AtomDiagramCoordinates.html