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fep-benchmark
Benchmark set for relative free energy calculations.
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Last push
76mo ago
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Change protonation state for CHEMBL3265030
75a2741
MCompChem
76mo ago
Update README.md
01c1da6
MCompChem
82mo ago
Update README.md
eea94f0
MCompChem
82mo ago
Add files via upload
b79f824
MCompChem
82mo ago
Create README.md
1e47615
MCompChem
82mo ago
Add files via upload
ca712ae
MCompChem
82mo ago
Create READMD.md
0b5eb27
MCompChem
82mo ago
Add files via upload
446402f
MCompChem
82mo ago
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MCompChem
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