GitHub - HanatoK/miscellaneous_scripts: Various scripts for my personal use

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Name		Name	Last commit message	Last commit date
Latest commit History 161 Commits
MFPT		MFPT
NAMD		NAMD
SMwST		SMwST
colvars_m4		colvars_m4
committor		committor
dbaasp		dbaasp
fit_plane		fit_plane
geodesic		geodesic
julia		julia
shell_scripts		shell_scripts
tcl_c		tcl_c
tica		tica
vmd		vmd
.gitignore		.gitignore
Metropolis-Hastings.py		Metropolis-Hastings.py
analysis.py		analysis.py
analyze_histo_1d.py		analyze_histo_1d.py
analyze_histo_2d.py		analyze_histo_2d.py
average.py		average.py
boltzmann_constant.py		boltzmann_constant.py
calc_avg_se.py		calc_avg_se.py
circular_stat.py		circular_stat.py
colvars_traj_to_csv.py		colvars_traj_to_csv.py
compute_derivatives.py		compute_derivatives.py
compute_dihedrals.py		compute_dihedrals.py
cubic_spline_pytorch.py		cubic_spline_pytorch.py
degFdegC.py		degFdegC.py
draw_fe_1D_multi.py		draw_fe_1D_multi.py
draw_fes_1D.py		draw_fes_1D.py
draw_fes_2D.py		draw_fes_2D.py
draw_fes_2D_2.py		draw_fes_2D_2.py
draw_fes_2D_3.py		draw_fes_2D_3.py
draw_fes_2D_multi.py		draw_fes_2D_multi.py
draw_fes_2D_nanma.py		draw_fes_2D_nanma.py
draw_fes_degree.R		draw_fes_degree.R
fesrmsd.R		fesrmsd.R
fesrmsd.py		fesrmsd.py
fesrmsd_2.py		fesrmsd_2.py
filter_minima.py		filter_minima.py
filter_traj.py		filter_traj.py
hillbert_curve_2d.py		hillbert_curve_2d.py
hillbert_curve_3d.py		hillbert_curve_3d.py
integrate1D.py		integrate1D.py
interactive.py		interactive.py
interp_path.py		interp_path.py
join.py		join.py
join_2.py		join_2.py
mergepmf.py		mergepmf.py
metad_average.py		metad_average.py
monitorCV.R		monitorCV.R
multi_linear_regression.py		multi_linear_regression.py
parse_hist.py		parse_hist.py
pdb_to_gro.ipynb		pdb_to_gro.ipynb
plotCVevolution.py		plotCVevolution.py
plot_all_dihedrals.py		plot_all_dihedrals.py
plot_bars_dgx2.py		plot_bars_dgx2.py
plot_colorbar_only.py		plot_colorbar_only.py
plot_colvars_traj.py		plot_colvars_traj.py
plot_egabf.py		plot_egabf.py
plot_fit_distribution.py		plot_fit_distribution.py
plot_four.py		plot_four.py
plot_rmsd.py		plot_rmsd.py
plot_rmsd_2.py		plot_rmsd_2.py
plot_traj_and_pmf.py		plot_traj_and_pmf.py
pmf.R		pmf.R
pmf_to_grad_1D.py		pmf_to_grad_1D.py
project.py		project.py
read_colvars_traj.py		read_colvars_traj.py
read_colvars_traj_new.py		read_colvars_traj_new.py
rename_files.py		rename_files.py
reparam.py		reparam.py
reparam_pytorch.py		reparam_pytorch.py
show_minimum.py		show_minimum.py
subplot.py		subplot.py
sum_count.py		sum_count.py
turbo_colormap.py		turbo_colormap.py
write_colvars_traj.py		write_colvars_traj.py

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Various scripts for my personal use

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