package changes

Dockerfile

@@ -7,7 +7,7 @@ COPY --link --chown=1000 ./ /usr/src/app
 COPY . .
 
 # install dependcies
-RUN conda install -y python=3.9 openmm=7.7 pandas numpy scikit-learn
+RUN conda install -y python=3.9 pandas numpy scikit-learn
 RUN pip install --no-cache-dir -r requirements.txt
 
 #if you need to download executable and run them switch to the default non-root user