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dimer

Here are 6 public repositories matching this topic...

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Advanced ASE Transition State Tools for ABACUS and Deep-Potential

  • UpdatedMar 10, 2025
  • Python

Generic IOT platform for Home Automation based on ESP8266/ESP32

  • UpdatedApr 1, 2021
  • C

This program converts PDB to FASTA sequence and maps pdb's mutation position to fasta's position.

  • UpdatedAug 27, 2022
  • Python

This repository provides scripts to generate vibrational displacement modes for DIMER transition state (TS) searches in crystalline structures.

  • UpdatedMar 10, 2025
  • Python

Scripts to faciliate programmatic dimer and cluster generation with CLUSTERGEN

  • UpdatedAug 9, 2019
  • Python

C library for SAXS calculation using Fast Manifold Fourier Transform with MPI support

  • UpdatedOct 26, 2017
  • C

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