GitHub topics: dimer
learningmatter-mit/PoTS
This repository provides scripts to generate vibrational displacement modes for DIMER transition state (TS) searches in crystalline structures.
Language: Python - Size: 554 KB - Last synced at: 2 days ago - Pushed at: 2 days ago - Stars: 0 - Forks: 0
QuantumMisaka/ATST-Tools
Advanced ASE Transition State Tools for ABACUS and Deep-Potential
Language: Python - Size: 118 MB - Last synced at: 2 months ago - Pushed at: 2 months ago - Stars: 26 - Forks: 11
Yurik72/ESPHomeController
Generic IOT platform for Home Automation based on ESP8266/ESP32
Language: C - Size: 2.8 MB - Last synced at: 12 months ago - Pushed at: about 4 years ago - Stars: 25 - Forks: 4
ShahidIqb/PPI_dimer_pdb2fasta
This program converts PDB to FASTA sequence and maps pdb's mutation position to fasta's position.
Language: Python - Size: 103 KB - Last synced at: about 2 years ago - Pushed at: over 2 years ago - Stars: 0 - Forks: 0
ignatovmg/libfmftsaxs
C library for SAXS calculation using Fast Manifold Fourier Transform with MPI support
Language: C - Size: 12.1 MB - Last synced at: about 2 years ago - Pushed at: over 7 years ago - Stars: 0 - Forks: 0
nbehrnd/clustergen_tools
Scripts to faciliate programmatic dimer and cluster generation with CLUSTERGEN
Language: Python - Size: 20.5 KB - Last synced at: 2 months ago - Pushed at: almost 6 years ago - Stars: 0 - Forks: 0
