Jean-Philip Piquemal

@jppiquem

Theoretical Chemistry Professor & Head - Sorbonne Université Adjunct Prof. | Fast using & | (My Views)

Paris, France
Vrijeme pridruživanja: ožujak 2012.

Tweetovi

Blokirali ste korisnika/cu @jppiquem

Jeste li sigurni da želite vidjeti te tweetove? Time nećete deblokirati korisnika/cu @jppiquem

  1. Prikvačeni tweet
    3. sij

    Interested in new generation Molecular Dynamics simulations? Check out the last version of the massively parallel Tinker-HP software : Accurate & Polarizable FFs Ready, Developer-Friendly and Free for Academics! GPUs version for 2020!

    Poništi
  2. proslijedio/la je Tweet
    3. velj

    Let's all go back to Coulomb-matrix + Wasserstein 😊

    Poništi
  3. proslijedio/la je Tweet
    30. sij

    La "Journée Chimie Théorique et Simulation Moléculaire" du pôle IdF/Nord aura lieu le jeudi 6 février à ChimieParisTech. Plus d'infos ici :

    Poništi
  4. proslijedio/la je Tweet
    30. sij

    New paper on the ability of the polarizable FF to reproduce partitioning of a charged solute in a mixed micelle; additive FF gave poor agreement.

    Poništi
  5. proslijedio/la je Tweet
    28. sij

    A Mountaineering Strategy to Excited States: Highly-Accurate Energies and Benchmarks for Medium Size Molecules

    Poništi
  6. 30. sij

    Good read: Overcoming orthogonal barriers in alchemical free energy calculations: On the relative merits of λ-variations, λ-extrapolations, and biasing.

    Poništi
  7. proslijedio/la je Tweet
    28. sij
    Poništi
  8. proslijedio/la je Tweet
    20. sij

    This is a terrible take. It totally misses the key point: handles >10k submissions and >25m downloads per month at a cost of only $1.3m /year. spends $193m (!) on publications, and spends $33.7m. Something stinks.

    Prikaži ovu nit
    Poništi
  9. proslijedio/la je Tweet
    30. sij
    Poništi
  10. proslijedio/la je Tweet
    29. sij
    Poništi
  11. 27. sij

    New Preprint NCIPLOT4: A New Step Towards a Fast Quantification of Noncovalent Interactions.

    Poništi
  12. proslijedio/la je Tweet
    24. sij

    We proudly present how cyanobacteria efficiently concentrate CO2 from the atmosphere with the remarkable photosynthetic complex I. Great collaboration with and .

    Poništi
  13. 27. sij

    Good read: Nonlocal kinetic energy density functionals for isolated systems obtained via local density approximation kernels

    Poništi
  14. 27. sij

    Need help on your lab cluster or local supercomputer? Just Slack us!!!!

    Poništi
  15. proslijedio/la je Tweet
    25. sij

    Phase Separation in Atomistic Simulations of Model Membranes

    Poništi
  16. 27. sij

    Good read: OPUS-Refine: A Fast Sampling-Based Framework for Refining Protein Backbone Torsion Angles and Global Conformation

    Poništi
  17. proslijedio/la je Tweet
    27. sij

    On the Polarization of Ligands by Proteins

    Poništi
  18. 26. sij

    Very interesting interview: Jack Dongarra presents: Adaptive Linear Solvers and Eigensolvers

    Poništi
  19. proslijedio/la je Tweet
    24. sij

    Live le supercalculateur de au c'est lui, encore merci à pour l'ITW 🙏

    Poništi
  20. proslijedio/la je Tweet

    Inauguré aujourd'hui, le est le fruit d’une collaboration entre les communautés de recherche 🇨🇵, en et en , et un constructeur internationalement reconnu 👉

    Prikaži ovu nit
    Poništi
  21. 24. sij

    Good read: Accelerating Molecular Docking by Parallelized Heterogeneous Computing - A Case Study of Performance, Quality of Results, and Energy-Efficiency using CPUs, GPUs, and FPGAs

    Poništi

Čini se da učitavanje traje već neko vrijeme.

Twitter je možda preopterećen ili ima kratkotrajnih poteškoća u radu. Pokušajte ponovno ili potražite dodatne informacije u odjeljku Status Twittera.

    Možda bi vam se svidjelo i ovo:

    ·