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Jean-Philip Piquemal

Identifiers

  • name variant Jean-Philip Piquemal 0.60 · backfill

Papers (37)

  1. Faster Molecular Dynamics with Neural Network Potentials via Distilled Multiple Time-Stepping and Non-Conservative Forces physics.chem-ph · 2026 · author #6
  2. Dual-LAO for calculating fast and robust relative binding free energies of simple and complex transformations physics.chem-ph · 2025 · author #4
  3. Real-Space Chemistry on Quantum Computers: A Fault-Tolerant Algorithm with Adaptive Grids and Transcorrelated Extension quant-ph · 2025 · author #5
  4. Quantum Circuits for the Metropolis-Hastings Algorithm quant-ph · 2025 · author #3
  5. Pushing the Accuracy Limit of Foundation Neural Network Models with Quantum Monte Carlo Forces and Path Integrals physics.chem-ph · 2025 · author #21
  6. Lambda-ABF-OPES: Faster Convergence with High Accuracy in Alchemical Free Energy Calculations physics.chem-ph · 2025 · author #7
  7. The Q-AMOEBA (CF) Polarizable Potential physics.chem-ph · 2025 · author #5
  8. VTX: Real-time high-performance molecular structure and dynamics visualization software cs.GR · 2025 · author #9
  9. Velocity Jumps for Molecular Dynamics physics.comp-ph · 2024 · author #6
  10. The need to implement FAIR principles in biomolecular simulations q-bio.BM · 2024 · author #92
  11. Shortcut to Chemically Accurate Quantum Computing via Density-based Basis-set Correction physics.chem-ph · 2024 · author #11
  12. FeNNol: an Efficient and Flexible Library for Building Force-field-enhanced Neural Network Potentials physics.chem-ph · 2024 · author #4
  13. Polylogarithmic-depth controlled-NOT gates without ancilla qubits quant-ph · 2023 · author #6
  14. Leveraging Analog Quantum Computing with Neutral Atoms for Solvent Configuration Prediction in Drug Discovery quant-ph · 2023 · author #11
  15. ReaxFF Simulations of Self-Assembled Monolayers On Silver Surfaces and Nanocrystals physics.chem-ph · 2023 · author #2
  16. Lambda-ABF: Simplified, Portable, Accurate and Cost-effective Alchemical Free Energy Computations physics.chem-ph · 2023 · author #6
  17. Smooth Particle Mesh Ewald-integrated stochastic Lanczos Many-body Dispersion algorithm physics.chem-ph · 2023 · author #3
  18. Greedy Gradient-free Adaptive Variational Quantum Algorithms on a Noisy Intermediate Scale Quantum Computer quant-ph · 2023 · author #7
  19. Overlap-ADAPT-VQE: Practical Quantum Chemistry on Quantum Computers via Overlap-Guided Compact Ans\"atze quant-ph · 2023 · author #6
  20. Force-Field-Enhanced Neural Network Interactions: from Local Equivariant Embedding to Atom-in-Molecule properties and long-range effects physics.chem-ph · 2023 · author #3
  21. Extension of the Trotterized Unitary Coupled Cluster to Triple Excitations physics.chem-ph · 2022 · author #4
  22. ANKH: A Generalized O(N) Interpolated Ewald Strategy for Molecular Dynamics Simulations math.NA · 2022 · author #3
  23. Generalized Many-Body Dispersion Correction through Random-phase Approximation for Chemically Accurate Density Functional Theory physics.chem-ph · 2022 · author #3
  24. Improving Condensed Phase Water Dynamics with Explicit Nuclear Quantum Effects: the Polarizable Q-AMOEBA Force Field physics.chem-ph · 2022 · author #5
  25. Accurate Deep Learning-aided Density-free Strategy for Many-Body Dispersion-corrected Density Functional Theory physics.chem-ph · 2022 · author #5
  26. Targeting the Major Groove of the Palindromic d(GGCGCC)2 Sequence by Oligopeptide Derivatives of Anthraquinone Intercalators physics.chem-ph · 2022 · author #7
  27. Calculating the ground state energy of benzene under spatial deformations with noisy quantum computing quant-ph · 2022 · author #2
  28. Development of the Quantum Inspired SIBFA Many-Body Polarizable Force Field: Enabling Condensed Phase Molecular Dynamics Simulations physics.chem-ph · 2022 · author #7
  29. On the Quantum Chemical Nature of Lead(II) "Lone Pair" physics.chem-ph · 2021 · author #2
  30. Nuclear Quantum Effects in liquid water at near classical computational cost using the adaptive Quantum Thermal Bath physics.chem-ph · 2021 · author #6
  31. Tinker-HP : Accelerating Molecular Dynamics Simulations of Large Complex Systems with Advanced Point Dipole Polarizable Force Fields using GPUs and Multi-GPUs systems physics.comp-ph · 2020 · author #12
  32. Assessment of SAPT and Supermolecular EDAs Approaches for the Development of Separable and Polarizable force fields physics.chem-ph · 2020 · author #4
  33. Velocity jump processes : an alternative to multi-timestep methods for faster and accurate molecular dynamics simulations physics.chem-ph · 2020 · author #4
  34. Quantum-Chemistry based design of halobenzene derivatives with augmented affinities for the HIV-1 viral G4/C16 base-pair physics.chem-ph · 2019 · author #6
  35. Accurate biomolecular simulations account for electronic polarization physics.chem-ph · 2019 · author #2
  36. Raising the Performance of the Tinker-HP Molecular Modeling Package [Article v1.0] cs.MS · 2019 · author #6
  37. A coherent derivation of the Ewald summation for arbitrary orders of multipoles: The self-terms physics.chem-ph · 2018 · author #5

Mentions

  • 2507.20583 #5 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2502.12708 #5 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2306.17159 #7 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2501.12750 #9 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2502.17233 #7 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2504.07948 #21 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2407.16584 #92 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2412.15073 #6 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2405.11567 #11 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2309.12129 #11 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2307.08006 #6 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2405.01491 #4 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2301.08734 #3 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2312.13206 #6 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 1906.01211 #6 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2307.10858 #2 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2301.10196 #6 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2307.02278 #3 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2212.12462 #4 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2212.08284 #3 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2210.09784 #3 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2203.15279 #7 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2201.00804 #7 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2203.05275 #2 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2206.13430 #5 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2203.15739 #5 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2105.10314 #2 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2102.00289 #6 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2008.01436 #4 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2011.01207 #12 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 1911.11100 #6 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2002.07109 #4 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 1805.10363 #5 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 1909.03732 #2 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2602.14975 #6 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal
  • 2506.11576 #3 · arxiv_oai · confidence 0.70 Jean-Philip Piquemal

Frequent Coauthors