warp-md 0.1.1__tar.gz → 0.1.2__tar.gz
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- {warp_md-0.1.1 → warp_md-0.1.2}/Cargo.lock +6 -6
- {warp_md-0.1.1 → warp_md-0.1.2}/PKG-INFO +1 -1
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-core/Cargo.toml +1 -1
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/Cargo.toml +1 -1
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-io/Cargo.toml +1 -1
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-py/Cargo.toml +1 -1
- {warp_md-0.1.1 → warp_md-0.1.2}/pyproject.toml +1 -1
- {warp_md-0.1.1 → warp_md-0.1.2}/Cargo.toml +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/LICENSE +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/README.md +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-core/src/elements.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-core/src/error.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-core/src/frame.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-core/src/interner.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-core/src/lib.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-core/src/selection.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-core/src/system.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/correlators/mod.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/correlators/multi_tau.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/correlators/ring.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/executor.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/feature_store.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/lib.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/common.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/conductivity.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/dielectric.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/dipole.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/equipartition.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/grouping.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/hbond.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/ion_pair.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/legacy/mod.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/legacy/param.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/legacy/topol.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/mod.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/msd.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/rotacf.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/structure_factor.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/analysis/water_count.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/mod.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/polymer/bond_angle.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/polymer/bond_length.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/polymer/chain_rg.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/polymer/common.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/polymer/contour.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/polymer/end_to_end.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/polymer/mod.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/polymer/persistence.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/rdf.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/rg.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/src/plans/rmsd.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/tests/correlators.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/tests/feature_store.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-engine/tests/trj_analysis_sample.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-io/src/dcd.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-io/src/gro.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-io/src/lib.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-io/src/pdb.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-io/src/xtc.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/crates/traj-py/src/lib.rs +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/python/warp_md/__init__.py +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/python/warp_md/builder.py +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/python/warp_md/cli.py +0 -0
- {warp_md-0.1.1 → warp_md-0.1.2}/python/warp_md/tests/test_cli_help.py +0 -0
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name = "traj-core"
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version = "0.1.
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version = "0.1.2"
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name = "traj-engine"
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dependencies = [
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name = "traj-gpu"
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dependencies = [
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name = "traj-io"
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name = "traj-py"
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