Louis Lagardère

Orcid: 0000-0002-7251-0910

According to our database1, Louis Lagardère authored at least 8 papers between 2016 and 2022.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of four.

Timeline

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PhD thesis 
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Bibliography

2022
Targeting the Major Groove of the Palindromic d(GGCGCC)<sub>2</sub> Sequence by Oligopeptide Derivatives of Anthraquinone Intercalators.
J. Chem. Inf. Model., 2022

ANKH: A Generalized O(N) Interpolated Ewald Strategy for Molecular Dynamics Simulations.
CoRR, 2022

Generalized Many-Body Dispersion Correction through Random-phase Approximation for Chemically Accurate Density Functional Theory.
CoRR, 2022

2020
Tinker-HP : Accelerating Molecular Dynamics Simulations of Large Complex Systems with Advanced Point Dipole Polarizable Force Fields using GPUs and Multi-GPUs systems.
CoRR, 2020

2019
Raising the Performance of the Tinker-HP Molecular Modeling Package on Intel's HPC Architectures: a Living Review [Article v1.0].
CoRR, 2019

2017
Tinker-OpenMM: Absolute and relative alchemical free energies using AMOEBA on GPUs.
J. Comput. Chem., 2017

2016
Scalable improvement of SPME multipolar electrostatics in anisotropic polarizable molecular mechanics using a general short-range penetration correction up to quadrupoles.
J. Comput. Chem., 2016

LICHEM: A QM/MM program for simulations with multipolar and polarizable force fields.
J. Comput. Chem., 2016


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