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Name: Brent Westbrook
Type: User
Company: @openforcefield
Bio: Staff Scientist at Open Force Field
Brent Westbrook's Projects
leaguecalc
ligand
lipoma
Literally Interpreting esPalOMA parameters
lox
Rust implementation of the lox language from Crafting Interpreters
macroni
Track your macros in the terminal
matemol
Rust port of checkmol
mintytab
misc
Miscellaneous command line tools written in Go
molden
updated mirror of the molden AUR package
mopac
Molecular Orbital PACkage
msm
use the modified seminario method to compute new bond and angle parameters
nodes
oleplot
simple graphing utility
openff-toolkit
Rust version of the OpenForceField tools
openmm
safe Rust interface to openmm-sys
openmm-sys
rust bindings to openmm
org-alert
System notifications of org agenda items
org-roam
Rudimentary Roam replica with Org-mode
pbqff
push-button quartic force fields
piston-tutorials
Tutorials for Piston
plastron
png
simple PNG encoding library
primes
programmingprojects
Chemistry-based projects for learning to program (in Rust)
psqs
quantum chemistry ProgramS and Queuing systemS
qcrab
Quantum Chemistry in Rust, Author Brent
rdkit-fork
rdkit-rs
RDKit interface in safe Rust
rdkit-sys
C and Rust wrappers for RDKit
rdkit-sys-fork
Rust crate for linking against the RDKit C++ API
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