# 安装依赖包
npm install
# 运行
npm run dev

npm run build:prod

cd /usr/local/etc/nginx/
vi /usr/local/etc/nginx/nginx.conf
# 编辑nginx.conf

    server {
        listen       8080;
        server_name  localhost;

        location / {
            root   /Users/calvin/Documents/molecular_search/dist/;
            index  index.html index.htm;
        }
     ......
     
# 重新加载配置：
sudo nginx -s reload 

# 部署应用后，重启：
cd /usr/local/Cellar/nginx/1.19.6/bin

# 快速停止
sudo nginx -s stop

# 启动
sudo nginx     

# 文件存储路径
file:
  mac:
    path: ~/file/
  linux:
    path: /home/aias/file/
  windows:
    path: D:/aias/file/
  # 文件大小 /M
  maxSize: 3000
    ...

# 运行程序

java -jar molecular-search-0.1.0.jar

# 拉取 向量引擎 镜像
sudo docker pull milvusdb/milvus:1.1.0-cpu-d050721-5e559c

mkdir -p /Users/calvin/milvus/conf
cd /Users/calvin/milvus/conf
wget https://raw.githubusercontent.com/milvus-io/milvus/v1.1.0/core/conf/demo/server_config.yaml

# 提示：
# 默认cache_size: 4GB，insert_buffer_size: 1GB
# 开发机建议改小，如：cache_size: 256MB，insert_buffer_size: 256MB

sudo docker run -d --name milvus_cpu_1.1.0 \
-p 19530:19530 \
-p 19121:19121 \
-v /Users/calvin/milvus/db:/var/lib/milvus/db \
-v /Users/calvin/milvus/conf:/var/lib/milvus/conf \
-v /Users/calvin/milvus/logs:/var/lib/milvus/logs \
-v /Users/calvin/milvus/wal:/var/lib/milvus/wal \
milvusdb/milvus:1.1.0-cpu-d050721-5e559c

################ 向量引擎 ###############
search:
  host: 127.0.0.1
  port: 19530
  indexFileSize: 1024 # maximum size (in MB) of each index file
  nprobe: 16
  nlist: 512
  collectionName: mols #collection name

P(=O)(OC[C@H]1O[C@@H](n2c3ncnc(N)c3nc2)[C@H](O)[C@@H]1F)(O)O

        String host = "127.0.0.1";
        int port = 19530;
        final String collectionName = "mols"; // collection name

        MilvusClient client = new MilvusGrpcClient();
        // Connect to Milvus server
        ConnectParam connectParam = new ConnectParam.Builder().withHost(host).withPort(port).build();
        try {
            Response connectResponse = client.connect(connectParam);
        } catch (ConnectFailedException e) {
            e.printStackTrace();
        }

        // 检查 collection 是否存在
        HasCollectionResponse hasCollection = hasCollection(client, collectionName);
        if (hasCollection.hasCollection()) {
            dropIndex(client, collectionName);
            dropCollection(client, collectionName);
        }
       ...

    me.aias.common.rdkit.RDKitInstance.java  

    public final class RDKitInstance {
        static {
            try {
                Path path = Paths.get("lib/native/macosx.x86_64/libGraphMolWrap.jnilib");
                System.load(path.toAbsolutePath().toString());
            } catch (UnsatisfiedLinkError e) {
                System.err.println("Native code library failed to load.\n" + e);
                System.exit(1);
            }
    //        System.loadLibrary("GraphMolWrap");
        }
    }