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cheq
v0.5.1 ExperimentalA pure Rust library and CLI for fast, dynamic partial charge calculation via the QEq method.
MIT Edition 2024
Command line utilitiesScience::Computational Chemistry::Electronic StructureScience::Computational Chemistry::Molecular Simulation #chemistry#molecular-dynamics#qeq#partial-charges#force-fields
Quick Verdict
- ✓Actively maintained (updated 32d ago)
- !Pre-1.0: API may have breaking changes
- ✓Permissive license (MIT)
Security
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Downloads
688
Dependents
4
Releases
6
Size
62KB
Deep Insights
📈
Strong growth momentum
115 downloads in the last 30 days (4/day), up 83% from the previous period.
Health Breakdown
Maintenance 18/25
Recency, release consistency, active ratio
Quality 14/25
Yanked ratio, deps, size, maturity, features
Community 8/20
Reverse deps, ownership, ecosystem
Popularity 3/15
Downloads, momentum, growth trend
Documentation 10/15
Docs, repo, license, metadata
Download Trend
Daily downloads · last 90 days
3/day avg+45%
Top Dependents
Most downloaded crates that depend on cheq
Version Adoption
v0.2.0
30%
v0.1.0
26%
v0.5.0
19%
v0.5.1
13%
v0.3.0
12%
Release Timeline
6 releasessince 2025
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Feature Flags
default =["cli"]
cli*
README
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Maintainers
Dependencies
12
direct dependencies
Dependents
4
crates depend on cheq