| BF_CHEBYSHEV |
Chebyshev polynomial basis functions. |
| BF_COMBINED |
Combining other basis functions types |
| BF_COSINE |
Fourier cosine basis functions. |
| BF_CUBIC_B_SPLINES |
Cubic B spline basis functions. |
| BF_CUSTOM |
Basis functions given by arbitrary mathematical expressions. |
| BF_FOURIER |
Fourier basis functions. |
| BF_GAUSSIANS |
Gaussian basis functions. |
| BF_LEGENDRE |
Legendre polynomials basis functions. |
| BF_POWERS |
Polynomial power basis functions. |
| BF_SINE |
Fourier sine basis functions. |
| BF_WAVELETS |
Daubechies Wavelets basis functions. |
| OPT_ADAM |
Adaptive moment estimation (ADAM) optimizer. |
| OPT_AVERAGED_SGD |
Averaged stochastic gradient decent with fixed step size. |
| OPT_DUMMY |
Dummy optimizer for debugging. |
| OPT_ROBBINS_MONRO_SGD |
Robbins-Monro stochastic gradient decent. |
| TD_CHI |
Chi distribution (static). |
| TD_CHISQUARED |
Chi-squared distribution (static). |
| TD_CUSTOM |
Target distribution given by an arbitrary mathematical expression (static or dynamic). |
| TD_EXPONENTIAL |
Exponential distribution (static). |
| TD_EXPONENTIALLY_MODIFIED_GAUSSIAN |
Target distribution given by a sum of exponentially modified Gaussian distributions (static). |
| TD_GAUSSIAN |
Target distribution given by a sum of Gaussian kernels (static). |
| TD_GENERALIZED_EXTREME_VALUE |
Generalized extreme value distribution (static). |
| TD_GENERALIZED_NORMAL |
Target distribution given by a sum of generalized normal distributions (static). |
| TD_GRID |
Target distribution from an external grid file (static). |
| TD_LINEAR_COMBINATION |
Target distribution given by linear combination of distributions (static or dynamic). |
| TD_MULTICANONICAL |
Multicanonical target distribution (dynamic). |
| TD_MULTITHERMAL_MULTIBARIC |
Multithermal-multibaric target distribution (dynamic). |
| TD_PRODUCT_COMBINATION |
Target distribution given by product combination of distributions (static or dynamic). |
| TD_PRODUCT_DISTRIBUTION |
Target distribution given by a separable product of one-dimensional distributions (static or dynamic). |
| TD_UNIFORM |
Uniform target distribution (static). |
| TD_VONMISES |
Target distribution given by a sum of Von Mises distributions (static). |
| TD_WELLTEMPERED |
Well-tempered target distribution (dynamic). |
| VES_DELTA_F |
Implementation of VES Delta F method |
| VES_LINEAR_EXPANSION |
Linear basis set expansion bias. |
| VES_OUTPUT_BASISFUNCTIONS |
Output basis functions to file. |
| VES_OUTPUT_FES |
Tool to output biases and free energy surfaces for VES biases from previously obtained coefficients. |
| VES_OUTPUT_TARGET_DISTRIBUTION |
Output target distribution to file. |
