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ModelZoo
Uni-Fold_pytorch
Commits
ad226e28
Commit
ad226e28
authored
Nov 04, 2024
by
yuhai
Browse files
Update run_monomer.sh
parent
37b17f17
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run_monomer.sh
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run_monomer.sh
View file @
ad226e28
#!/bin/bash
#!/bin/bash
export
DTKROOT
=
/opt/dtk
-22.04.2
export
DTKROOT
=
/opt/dtk
export
AMDGPU_TARGETS
=
"gfx9
06
"
export
AMDGPU_TARGETS
=
"gfx9
28
"
export
ROCMVER
=
2
2
.04.2
export
ROCMVER
=
2
4
.04.2
export
DTK_HOME
=
/opt/dtk
-22.04.2
export
DTK_HOME
=
/opt/dtk
export
ROCM_PATH
=
${
DTK_HOME
}
export
ROCM_PATH
=
${
DTK_HOME
}
export
HIP_PATH
=
${
DTK_HOME
}
/hip
export
HIP_PATH
=
${
DTK_HOME
}
/hip
export
PATH
=
${
DTK_HOME
}
/bin:
${
DTK_HOME
}
/llvm/bin:
${
DTK_HOME
}
/hip/bin:
${
DTK_HOME
}
/miopen/bin:
$PATH
export
PATH
=
${
DTK_HOME
}
/bin:
${
DTK_HOME
}
/llvm/bin:
${
DTK_HOME
}
/hip/bin:
${
DTK_HOME
}
/miopen/bin:
$PATH
...
@@ -11,16 +11,16 @@ export INCLUDE=${DTK_HOME}/include:${DTK_HOME}/hip/include:${DTK_HOME}/llvm/incl
...
@@ -11,16 +11,16 @@ export INCLUDE=${DTK_HOME}/include:${DTK_HOME}/hip/include:${DTK_HOME}/llvm/incl
export
C_INCLUDE_PATH
=
${
DTK_HOME
}
/include:
${
DTK_HOME
}
/hip/include:
${
DTK_HOME
}
/llvm/include:
$C_INCLUDE_PATH
export
C_INCLUDE_PATH
=
${
DTK_HOME
}
/include:
${
DTK_HOME
}
/hip/include:
${
DTK_HOME
}
/llvm/include:
$C_INCLUDE_PATH
export
CPLUS_INCLUDE_PATH
=
${
DTK_HOME
}
/include:
$CPLUS_INCLUDE_PATH
export
CPLUS_INCLUDE_PATH
=
${
DTK_HOME
}
/include:
$CPLUS_INCLUDE_PATH
export
MIOPEN_SYSTEM_DB_PATH
=
${
DTK_HOME
}
/miopen/share/miopen/db/
export
MIOPEN_SYSTEM_DB_PATH
=
${
DTK_HOME
}
/miopen/share/miopen/db/
source
/root
/env.sh
source
.
/env.sh
cd
/root/Uni-Fold
-main
cd
/root/Uni-Fold
fasta_path
=
/root/Uni-Fold
-main
/data/T1024.fasta
fasta_path
=
/root/Uni-Fold/data/T1024.fasta
input_dir_base
=
/root/Uni-Fold
-main
/data
input_dir_base
=
/root/Uni-Fold/data
output_dir_base
=
/root/Uni-Fold
-main
/data
output_dir_base
=
/root/Uni-Fold/data
database_dir
=
/alphafold/
alphafold/
database_dir
=
/alphafold/
max_template_date
=
2020-05-01
max_template_date
=
2020-05-01
model_name
=
model_2_ft
model_name
=
model_2_ft
param_path
=
/root/Uni-Fold
-main
/Alphafold/monomer.unifold.pt
param_path
=
/root/Uni-Fold/Alphafold/monomer.unifold.pt
echo
"Starting homogeneous searching..."
echo
"Starting homogeneous searching..."
python unifold/homo_search.py
\
python unifold/homo_search.py
\
...
@@ -41,7 +41,7 @@ python unifold/homo_search.py \
...
@@ -41,7 +41,7 @@ python unifold/homo_search.py \
echo
"Starting prediction..."
echo
"Starting prediction..."
fasta_file
=
$(
basename
$fasta_path
)
fasta_file
=
$(
basename
$fasta_path
)
target_name
=
${
fasta_file
%.fa*
}
target_name
=
${
fasta_file
%.fa*
}
export
CUDA_VISIBLE_DEVICES
=
0,1,2,3
python3 unifold/inference.py
\
python3 unifold/inference.py
\
--model_name
=
$model_name
\
--model_name
=
$model_name
\
--param_path
=
$param_path
\
--param_path
=
$param_path
\
...
...
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