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OpenDAS
FastFold
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17bf238e
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17bf238e
authored
Aug 17, 2023
by
zhuwenwen
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update readme and version
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安装FastFold,你需要
+
Python 3.8 或者 3.9.
### 使用pip安装
### 使用pip
方式
安装
fastfold whl包下载目录:
[
https://cancon.hpccube.com:65024/4/main/fastfold/dtk23.04
](
https://cancon.hpccube.com:65024/4/main/fastfold/dtk23.04
)
根据对应的pytorch版本和python版本,下载对应fastfold的whl包
...
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@@ -12,47 +12,42 @@ fastfold whl包下载目录:[https://cancon.hpccube.com:65024/4/main/fastfold/
pip
install
fastfold
*
(
下载的fastfold的whl包
)
```
### 使用源码安装
### 使用源码
编译方式
安装
#### 编译环境准备
pytorch whl包下载目录:
[
https://cancon.hpccube.com:65024/4/main/pytorch/dtk23.04
](
https://cancon.hpccube.com:65024/4/main/pytorch/dtk23.04
)
根据python版本,下载对应pytorch的whl包
提供2种环境准备方式:
1.
基于光源pytorch基础镜像环境:镜像下载地址:
[
https://sourcefind.cn/#/image/dcu/pytorch
](
https://sourcefind.cn/#/image/dcu/pytorch
)
,根据pytorch、python、dtk及系统下载对应的镜像版本。
2.
基于现有python环境:安装pytorch,pytorch whl包下载目录:
[
https://cancon.hpccube.com:65024/4/main/pytorch/dtk23.04
](
https://cancon.hpccube.com:65024/4/main/pytorch/dtk23.04
)
,根据python、dtk版本,下载对应pytorch的whl包。安装命令如下:
```
shell
pip
install
torch
*
(
下载的torch的whl包
)
pip
install
setuptools
==
59.5.0 wheel
```
#### 源码编译安装
-
代码下载
```
shell
pip
install
setuptools
=
59.5.0 wheel
git clone https://developer.hpccube.com/codes/aicomponent/fastfold
# 根据需要的分支进行切换
```
#### 编译安装
```
shell
git clone https://developer.hpccube.com/codes/aicomponent/fastfold
# 根据需要的分支进行切换
cd
fastfold
-
提供2种源码编译方式(进入fastfold目录):
```
1. 编译whl包并安装
export CPLUS_INCLUDE_PATH=$ROCM_PATH/include:$ROCM_PATH/cuda/targets/x86_64-linux/include:$CPLUS_INCLUDE_PATH
1、 编译whl包并安装
python setup.py bdist_wheel
python setup.py bdist_wheel
pip install dist/fastfold*
2、 直接编译安装
python setup.py
install
2. 源码编译安装
export CPLUS_INCLUDE_PATH=$ROCM_PATH/include:$ROCM_PATH/cuda/targets/x86_64-linux/include:$CPLUS_INCLUDE_PATH
python3 setup.py install
```
## 安装包命名
例: fastfold-0.2.1+git9f6252f.abi0.dtk2304.torch1.10-cp38-cp38-manylinux2014_x86_64.whl
-
fastfold: 安装包名称;
-
0.2.1: 安装包版本号;
-
git9f6252f: git号;
-
abi0: 对应centos和rocky多系统的标识,取值为abi0(centos7),abi1(rocky8),可使用命令行动态查询获取辅助判断(echo '#include
<string>
' | gcc -x c++ -E -dM - | fgrep _GLIBCXX_USE_CXX11_ABI);
-
dtk2304: 对应dtk大版本号,命令行动态查询取值(/opt/dtk-23.04/.info/rocm_version);
-
torch1.10: 对应构建的torch版本号,命令行动态查询取值(torch.
\_\_
version__);
-
cp38-cp38: 对应python版本号;
-
manylinux2014_x86_64: 系统架构;
## 版本号查询
-
fastfold.
\_\_
version__
:
与官方版本同步,查询该
安装包
的版本号,例如0.2.
1(基于官方0.2.0修改)
;
-
python -c "import fastfold; print(
fastfold.
\_\_
version__
)",版本号
与官方版本同步,查询该
软件
的版本号,例如0.2.
0
;
## Known Issue
-
无
## Note
+
若使用 pip install 下载安装过慢,可添加源:-i https://pypi.tuna.tsinghua.edu.cn/simple/
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