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13321_2016_139_MOESM1_ESM.py (1.63 kB)

MOESM1 of AutoDock VinaXB: implementation of XBSF, new empirical halogen bond scoring function, into AutoDock Vina

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posted on 2016-05-18, 05:00 authored by Mathew Koebel, Grant Schmadeke, Richard Posner, Suman Sirimulla
Additional file 1. RMSD program.

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STLCOP FRIF

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    Journal of Cheminformatics

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    Halogen bondScoring functionAutodockVinaSigma holeXBSF

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    CC BY + CC0

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