Postdoctoral fellow with Open Force Field Initiative and Gilson lab at UC San Diego.
Molecular dynamics, computational chemistry, and biopolymer force fields.
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Open Force Field Initiative
- https://openforcefield.org/
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loos
loos PublicForked from GrossfieldLab/loos
LOOS: a lightweight object-oriented structure analysis library
C++
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itc_two_site_fit
itc_two_site_fit PublicFit ITC data to a model with two interdependent and non-equivalent binding sites.
Python
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forcebalance
forcebalance PublicForked from leeping/forcebalance
Systematic force field optimization.
Python
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