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feasst
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This is the public discussion list for FEASST: Free Energy and Advanced Sampling Simulation Toolkit (
https://doi.org/10.18434/
M3S095
). Messages cannot contain any sensitive or proprietary information.
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harold...@nist.gov
11/6/22
Questions and answers regarding FEASST
Most users contact me directly, but I thought I would include my answers to some questions that may
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Questions and answers regarding FEASST
Most users contact me directly, but I thought I would include my answers to some questions that may
11/6/22
harold...@nist.gov
11/6/22
FEASST at AIChE Annual Meeting 2022
FEASST will be featured in a presentation at the AIChE Annual meeting. Session: Software Engineering
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FEASST at AIChE Annual Meeting 2022
FEASST will be featured in a presentation at the AIChE Annual meeting. Session: Software Engineering
11/6/22
Harold Hatch
10/24/19
Announcement
Major FEASST update
FEASST version 0.8 is a completely new rewrite of the code and was recently pushed to the public
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Announcement
Major FEASST update
FEASST version 0.8 is a completely new rewrite of the code and was recently pushed to the public
10/24/19
Harold Hatch
10/11/19
FEASST workshop at AIChE 2019 Annual Meeting in Orlando
FEASST will be included in the AIChE workshop "W5: CoMSEF Workshop: Hands-On with Molecular
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FEASST workshop at AIChE 2019 Annual Meeting in Orlando
FEASST will be included in the AIChE workshop "W5: CoMSEF Workshop: Hands-On with Molecular
10/11/19
harold...@nist.gov
2/26/19
FEASST at simSAS 2019 CECAM Workshop
I will be presenting on "Simulations of concentrated solutions of monoclonal antibodies and
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FEASST at simSAS 2019 CECAM Workshop
I will be presenting on "Simulations of concentrated solutions of monoclonal antibodies and
2/26/19
harold...@nist.gov
2/26/19
FEASST at ACS Orlando 2019
I will be presenting on "Improving reproducibility of molecular simulations with reference data
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FEASST at ACS Orlando 2019
I will be presenting on "Improving reproducibility of molecular simulations with reference data
2/26/19
Harold Hatch
9/28/18
FEASST at AIChE Annual Meeting 2018
I will present a poster at the AIChE Annual meeting in Pittsburgh, PA Session: Poster Session:
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FEASST at AIChE Annual Meeting 2018
I will present a poster at the AIChE Annual meeting in Pittsburgh, PA Session: Poster Session:
9/28/18
harold...@nist.gov
7/9/18
FOMMS 2018
Will be available to discuss FEASST at the FOMMS 2018 meeting.
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FOMMS 2018
Will be available to discuss FEASST at the FOMMS 2018 meeting.
7/9/18
harold...@nist.gov
6/26/18
Software demonstration at the 20th Symposium on Thermophysical Properties
I will be presenting FEASST at the software demonstrations on 6/27 during the 20th Symposium on
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Software demonstration at the 20th Symposium on Thermophysical Properties
I will be presenting FEASST at the software demonstrations on 6/27 during the 20th Symposium on
6/26/18
Harold Hatch
6/5/18
Testing
Here is a test of the first message sent to the feasst email list. -- Harold Wickes Hatch, Ph.D.
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Testing
Here is a test of the first message sent to the feasst email list. -- Harold Wickes Hatch, Ph.D.
6/5/18