Molecular Simulations Group

@coutinholab

Molecular simulations group at the department of Pharmaceutical Chemistry at Bombay College of Pharmacy. [Account operated by ]

Mumbai, India
Vrijeme pridruživanja: rujan 2018.

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  1. proslijedio/la je Tweet
    25. sij

    I am pleased to announce that and I have been working on bringing AmberTools to ! We are offering builds for Linux (x64 and ppc64le) AND, finally, MacOS! Please, test it and report any issues you find:

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  2. proslijedio/la je Tweet
    9. sij

    Please Re-tweet: Immediate Postdoc in Membrane Protein Allostery/Drug Binding Free Energy modeling in my group at Carnegie Mellon University . Salary is generous-Pittsburgh is inexpensive and human-friendly place to live. Apply to

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  3. Poništi
  4. ┏━━┓┏━━┓┏━━┓┏━━┓ ┗━┓┃┃┏┓┃┗━┓┃┃┏┓┃ ┏━┛┃┃┃┃┃┏━┛┃┃┃┃┃ All the best ┃┏━┛┃┃┃┃┃┏━┛┃┃┃┃ ┃┗━┓┃┗┛┃┃┗━┓┃┗┛┃ ┗━━┛┗━━┛┗━━┛┗━━┛

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  5. Merry Christmas to one and all.

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  6. proslijedio/la je Tweet
    13. pro 2019.

    I will recruit two postdoctoral researchers in 2020. Projects involve structure-based discovery of GPCR ligands using molecular docking screening and molecular dynamics simulations to understand GPCR activation. Contact me if you are interested!

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  8. proslijedio/la je Tweet

    Should Coffee ☕️ go in Materials and Methods, Acknowledgements or Author list?

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  9. proslijedio/la je Tweet
    10. pro 2019.

    "...the buried treasure is the Excel file in the supplementary material, which contains SMILES and measured data for >17K compounds. There's also a very useful PDF which explains the columns in that file..." --RDKit Blog:

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  10. proslijedio/la je Tweet
    9. pro 2019.

    Do you already know KIMMDY? The new simulation scheme enables bond scissions in all-atom simulations: - developed by researchers at , including Benedikt Rennekamp (also member of )

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  11. proslijedio/la je Tweet
    1. pro 2019.

    📢ANNOUNCEMENT📢 DI .FM is celebrating 20 years and you’re invited! Enter our giveaway at daily until Dec 20 for your chance to score a pair of Bose headphones + 2 years of DI .FM Premium!

    difm20th anniversary giveaway bose premium headphones subscription artwork announcement
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  12. proslijedio/la je Tweet
    4. pro 2019.

    Don’t miss Dr. Ken Borrelli’s online presentation next Tuesday demonstrating the ways in which IFD-MD can significantly increase the impact of structure-based . Register here:

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  13. Flight attendant:Is there a doctor onboard? Dad:*nudging me* should've been you Me:Not now Dad Dad:Not asking for mol. Modeller to help, are they? Me:There's a med emergency happening right now Dad:Go see if Deep Learning solves the problem.

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  14. proslijedio/la je Tweet
    26. stu 2019.

    The Compound Management and Screening Center of the MPI Dortmund is looking for a Cheminformatics scientist. Please retweet.

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  15. proslijedio/la je Tweet

    Another ASAP article (headed towards issue 2) out, "Lessons Learned from the Calculation of One-Dimensional Potentials of Mean Force” Issue 2 is slated to be out in early December.

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  16. Poništi
  17. proslijedio/la je Tweet
    16. stu 2019.

    We're still looking for postdocs to join the Initiative! Come work with us in NYC, San Diego, Irvine, Davis, or Boulder!

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  18. proslijedio/la je Tweet
    18. stu 2019.

    We’re hiring! If you’re looking for a postdoc, please apply. RTs appreciated.

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  19. proslijedio/la je Tweet
    16. stu 2019.

    Insights to the Binding of a Selective Adenosine A3 Receptor Antagonist using Molecular Dynamic Simulations, MM-PBSA and MM-GBSA Free Energy Calculations and Mutagenesis

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  20. proslijedio/la je Tweet
    9. stu 2019.

    We're looking for new postdocs! Please RT!

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