Of course. Here is a well-structured and detailed bug report in English, based on our extensive troubleshooting. You can copy and paste this entire text to create a ...
ABSTRACT: Protein kinase inhibitors (PKIs) are widely used in the treatment of various human cancers. Still, their applications are limited by drug resistance (both intrinsic and acquired) and adverse ...
Department of Chemistry and Biochemistry, Bailey College of Science and Mathematics, California Polytechnic State University, San Luis Obispo, California 93407, United States Scientific software ...
1 Biosystems and Agricultural Engineering, University of Kentucky, Lexington, KY, United States 2 Department of Chemical and Materials Engineering, University of Kentucky, Lexington, KY, United States ...
In computational chemistry, molecules are often represented as molecular graphs, which must be converted into multidimensional vectors for processing, particularly in machine learning applications.
GUIDEMOL is a Python computer program based on the RDKit software to process molecular structures and calculate molecular descriptors with a graphical user interface using the tkinter package. It can ...
This article demonstrates how to create Chemical Space Networks (CSNs) using a Python RDKit and NetworkX workflow. CSNs are a type of network visualization that depict compounds as nodes connected by ...
Streamlit is an open-source Python coding framework for building web-applications or “web-apps” and is now being used by researchers to share large data sets from published studies and other resources ...
Some results have been hidden because they may be inaccessible to you
Show inaccessible results
Feedback