溶液NMR / DISTANCE-GEOMETRY DG REFINED BY SIMULATED ANNEALING SA, AMBER FORCE FIELD IN MOLECULAR DYNAMICS COMPUTATION MD, CONJUGATE GRADIENTS ALGORITHM IN FINAL MINIMIZATION
手法: DISTANCE-GEOMETRY DG REFINED BY SIMULATED ANNEALING SA, AMBER FORCE FIELD IN MOLECULAR DYNAMICS COMPUTATION MD, CONJUGATE GRADIENTS ALGORITHM IN FINAL MINIMIZATION ソフトェア番号: 1 詳細: AMBER FORCE FIELD WAS USED IN THE MOLECULAR DYNAMICS COMPUTATION MD AND THE GONJUGATE GRADIENTS ALGORITHIM IN THE FINAL MINIMIZATION
NMRアンサンブル
コンフォーマー選択の基準: LEAST RESTRAINT VIOLATIN 計算したコンフォーマーの数: 100 / 登録したコンフォーマーの数: 19