PDB2DAT: Automating LAMMPS data file generation from PDB molecular systems using Python, Rdkit, and Pysimm

Research output: Contribution to journalArticleScientificpeer-review

38 Downloads (Pure)

Fingerprint

Dive into the research topics of 'PDB2DAT: Automating LAMMPS data file generation from PDB molecular systems using Python, Rdkit, and Pysimm'. Together they form a unique fingerprint.

INIS

Keyphrases

Engineering

Material Science