Objectively and automatically building multi-conformer ligand models in electron densities - Archive ouverte HAL Access content directly
Conference Papers Year : 2017

Objectively and automatically building multi-conformer ligand models in electron densities

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Physics [physics] Physics [physics] Biological Physics [physics.bio-ph] Computer Science [cs] Bioinformatics [q-bio.QM]

Amélie HELIOU  : Connect in order to contact the contributor

https://hal.inria.fr/hal-01569829

Submitted on : Thursday, July 27, 2017-4:37:30 PM

Last modification on : Tuesday, November 29, 2022-12:02:10 PM

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hal-01569829 , version 1 (27-07-2017)

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  • HAL Id : hal-01569829 , version 1

Cite

Gydo Van Zundert, Daniel Keedy, Pooja Suresh, Amélie Héliou, Kenneth Borrelli, et al.. Objectively and automatically building multi-conformer ligand models in electron densities. Conformational ensembles from experimental data and computer simulations, Aug 2017, Berlin, Germany. ⟨hal-01569829⟩

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