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Software Infrastructure

Tersimpan di:
Main Authors: Boothroyd, Simon, Chodera, John D., Mobley, David L., Smith, Daniel G. A., Wagner, Jeffrey R., Wang, Lee Ping
Format: info Proceeding
Bahasa: eng
Terbitan: , 2019
Subjects:
Open Force Field Initiative
OFF toolkit
SMIRNOFF
infrastructure
software
force field
Online Access: https://zenodo.org/record/3243683
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Internet

https://zenodo.org/record/3243683

Lihat Juga

  • Software Science at the Open Force Field Consortium
    oleh: Wagner, Jeffrey, et al.
    Terbitan: (2020)
  • Fitting and benchmarking condensed-phase properties
    oleh: Boothroyd, Simon, et al.
    Terbitan: (2019)
  • Dataset associated with the manuscript titled "Capturing non-local through-bond effects when fragmenting molecules for quantum chemical torsion scans"
    oleh: Stern, Chaya D., et al.
    Terbitan: (2020)
  • Software and Science at the Open Force Field Initiative (NIH ODSS/BISDI Talk)
    oleh: Jeff Wagner
    Terbitan: (2021)
  • The Open Force Field Initiative and Open Science for Binding Prediction
    oleh: Mobley, David, et al.
    Terbitan: (2020)
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