jinysun commited on
Commit
36f28fb
1 Parent(s): 796be6a

Update app.py

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Files changed (1) hide show
  1. app.py +13 -4
app.py CHANGED
@@ -1,3 +1,10 @@
 
 
 
 
 
 
 
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  import streamlit as st
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  import pandas as pd
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  import rdkit
@@ -54,8 +61,10 @@ if option =="🎈Acceptor":
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  st.subheader("👨‍🔬**Input the SMILES of Acceptor Molecule**")
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  molecule = st.text_input("👨‍🔬**Input the SMILES of Acceptor Molecule**", label_visibility="hidden" )
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  acceptor= st_ketcher(molecule )
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- st.subheader("💗**PCE prediction**")
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- st.subheader(f"🏆**New SMILES of edited acceptor molecules**: {acceptor}")
 
 
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  st.subheader(":black[**🧡Input the SMILES of Donor Molecule**]")
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  donor= st.text_input(":black[**🧡Input the SMILES of Donor Molecule**]", label_visibility="hidden")
@@ -63,8 +72,8 @@ if option =="🎈Donor":
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  st.subheader("👨‍🔬**Input the SMILES of Donor Molecule**" )
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  do= st.text_input("👨‍🔬**Input the SMILES of Donor Molecule**" , label_visibility="hidden")
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  donor = st_ketcher(do)
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- st.subheader("💗**PCE prediction**")
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- st.subheader(f"🏆**New SMILES of edited donor molecules**: {donor}")
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  st.subheader(":black[**🧡Input the SMILES of Acceptor Molecule**]")
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  acceptor = st.text_input(":black[**🧡Input the SMILES of Acceptor Molecule**]", label_visibility="hidden")
 
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+ # -*- coding: utf-8 -*-
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+ """
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+ Created on Sun Nov 3 08:48:11 2024
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+
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+ @author: BM109X32G-10GPU-02
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+ """
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+
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  import streamlit as st
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  import pandas as pd
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  import rdkit
 
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  st.subheader("👨‍🔬**Input the SMILES of Acceptor Molecule**")
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  molecule = st.text_input("👨‍🔬**Input the SMILES of Acceptor Molecule**", label_visibility="hidden" )
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  acceptor= st_ketcher(molecule )
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+
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+ st.subheader("💗**PCE prediction**")
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+
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+ st.subheader(f"🏆**New SMILES of edited acceptor molecules**: {acceptor}")
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  st.subheader(":black[**🧡Input the SMILES of Donor Molecule**]")
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  donor= st.text_input(":black[**🧡Input the SMILES of Donor Molecule**]", label_visibility="hidden")
 
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  st.subheader("👨‍🔬**Input the SMILES of Donor Molecule**" )
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  do= st.text_input("👨‍🔬**Input the SMILES of Donor Molecule**" , label_visibility="hidden")
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  donor = st_ketcher(do)
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+ st.subheader("💗**PCE prediction**")
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+ st.subheader(f"🏆**New SMILES of edited donor molecules**: {donor}")
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  st.subheader(":black[**🧡Input the SMILES of Acceptor Molecule**]")
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  acceptor = st.text_input(":black[**🧡Input the SMILES of Acceptor Molecule**]", label_visibility="hidden")