/tools/masif-neosurf
masif-neosurf
LPDI-EPFL/masif-neosurf
165 stars24 forksPythonAdded February 4, 2026
summary
MaSIF-neosurf is a computational tool designed for surface-based protein design, specifically targeting protein-ligand interactions. It employs deep learning techniques to analyze and generate molecular surfaces, facilitating the design of proteins that can interact with small molecules.
description
MaSIF-neosurf: surface-based protein design for ternary complexes.
topics
drug-designgeometric-deep-learningmolecular-surfaceprotein-design
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