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SParTA
PuReMD
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ce38bd037cd0c9d99e6a9cfe2fa6fbda54e05ed0
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9
main
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protected
pg-puremd-charge-solver-opt-sdsc-hackaton
dummy-atom-support
tensorflow_update_v2
restraint_support
energy_minim
new_setup
tensorflow_update
qeq-nonzero-net-charge
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v1.0-rc1
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PuReMD
sPuReMD
src
forces.c
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3 years ago
ce38bd03
add support for dummy atom (only in BGF format with 'X' keyword for dummy atoms')
· ce38bd03
Kaymak, Cagri
authored
3 years ago
ce38bd03
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add support for dummy atom (only in BGF format with 'X' keyword for dummy atoms')
Kaymak, Cagri
authored
3 years ago
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