bump deepmd version (#41)

* promote run deps, bump prefect and mace versions

* reorganize pyproject toml

* test caching

* disable granular cache in eos

* bump deepmd

* try avoiding release error in pr #40

* clean up files

pyproject.toml

@@ -62,12 +62,13 @@ test = [
     "pytest",
     "pytest-xdist",
     "prefect==3.1.11",
-    "pymatgen@git+https://github.com/chiang-yuan/pymatgen" # hotfix for deprecated pymatgen property https://github.com/materialsproject/pymatgen/pull/4242
+    "pymatgen>=2025.1.9"
 ]
 mace = [
     "mace-torch==0.3.9",
 ]
 deepmd = [
+    "torch==2.2.0",
     "deepmd-kit@git+https://github.com/deepmodeling/deepmd-kit.git@v3.0.0b4"
 ]
 

serve/models/alerts.py

@@ -1,4 +0,0 @@
-import streamlit as st
-
-
-st.markdown("# Alerts")

serve/models/bugs.py

@@ -1,4 +0,0 @@
-import streamlit as st
-
-
-st.markdown("# Bugs")

serve/tools/history.py

@@ -1,28 +0,0 @@
-import plotly.express as px
-import streamlit as st
-
-st.markdown("# History")
-
-
-
-df = px.data.gapminder()
-
-fig = px.scatter(
-    df.query("year==2007"),
-    x="gdpPercap",
-    y="lifeExp",
-    size="pop",
-    color="continent",
-    hover_name="country",
-    log_x=True,
-    size_max=60,
-)
-
-tab1, tab2 = st.tabs(["Streamlit theme (default)", "Plotly native theme"])
-with tab1:
-    # Use the Streamlit theme.
-    # This is the default. So you can also omit the theme argument.
-    st.plotly_chart(fig, theme="streamlit", use_container_width=True)
-with tab2:
-    # Use the native Plotly theme.
-    st.plotly_chart(fig, theme=None, use_container_width=True)

serve/tools/search.py

@@ -1,4 +0,0 @@
-import streamlit as st
-
-
-st.markdown("# Search")