CAESAR: A New Conformer Generation Algorithm Based on Recursive Buildup and Local Rotational Symmetry Consideration

Journal of Chemical Information and Modeling - Tập 47 Số 5 - Trang 1923-1932 - 2007
Jiabo Li1, Tedman Ehlers1, Jon M. Sutter1, Shikha Varma‐O'Brien1, Johannes Kirchmair1
1Accelrys Inc., 10188 Telesis Court, San Diego, California 92121, and Computer Aided Molecular Design Group, Department of Pharmaceutical Chemistry, Institute of Pharmacy, University of Innsbruck, Innrain 52, A-6020 Innsbruck, Austria

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