#include "md_enums.h"
-const char *enum_name(int index, int max_index, const char *names[])
+const char* enum_name(int index, int max_index, const char* names[])
{
if (index < 0 || index >= max_index)
{
- static const char *undef = "no name defined";
+ static const char* undef = "no name defined";
return undef;
}
else
}
}
-const char *yesno_names[BOOL_NR+1] =
-{
- "no", "yes", nullptr
-};
+const char* yesno_names[BOOL_NR + 1] = { "no", "yes", nullptr };
-const char *ei_names[eiNR+1] =
-{
- "md", "steep", "cg", "bd", "sd2 - removed", "nm", "l-bfgs", "tpi", "tpic", "sd", "md-vv", "md-vv-avek", "mimic", nullptr
-};
+const char* ei_names[eiNR + 1] = { "md", "steep", "cg", "bd", "sd2 - removed",
+ "nm", "l-bfgs", "tpi", "tpic", "sd",
+ "md-vv", "md-vv-avek", "mimic", nullptr };
-const char *ecutscheme_names[ecutsNR+1] = {
- "Verlet", "Group", nullptr
-};
+const char* ecutscheme_names[ecutsNR + 1] = { "Verlet", "Group", nullptr };
-const char *erefscaling_names[erscNR+1] = {
- "No", "All", "COM", nullptr
-};
+const char* erefscaling_names[erscNR + 1] = { "No", "All", "COM", nullptr };
-const char *eel_names[eelNR+1] = {
- "Cut-off", "Reaction-Field", "Generalized-Reaction-Field (unused)",
- "PME", "Ewald", "P3M-AD", "Poisson", "Switch", "Shift", "User",
- "Generalized-Born (unused)", "Reaction-Field-nec", "Encad-shift",
- "PME-User", "PME-Switch", "PME-User-Switch",
- "Reaction-Field-zero", nullptr
-};
+const char* eel_names[eelNR + 1] = { "Cut-off",
+ "Reaction-Field",
+ "Generalized-Reaction-Field (unused)",
+ "PME",
+ "Ewald",
+ "P3M-AD",
+ "Poisson",
+ "Switch",
+ "Shift",
+ "User",
+ "Generalized-Born (unused)",
+ "Reaction-Field-nec",
+ "Encad-shift",
+ "PME-User",
+ "PME-Switch",
+ "PME-User-Switch",
+ "Reaction-Field-zero",
+ nullptr };
-const char *eewg_names[eewgNR+1] = {
- "3d", "3dc", nullptr
-};
+const char* eewg_names[eewgNR + 1] = { "3d", "3dc", nullptr };
-const char *eljpme_names[eljpmeNR+1] = {
- "Geometric", "Lorentz-Berthelot", nullptr
-};
+const char* eljpme_names[eljpmeNR + 1] = { "Geometric", "Lorentz-Berthelot", nullptr };
-const char *evdw_names[evdwNR+1] = {
- "Cut-off", "Switch", "Shift", "User", "Encad-shift",
- "PME", nullptr
-};
+const char* evdw_names[evdwNR + 1] = { "Cut-off", "Switch", "Shift", "User",
+ "Encad-shift", "PME", nullptr };
-const char *econstr_names[econtNR+1] = {
- "Lincs", "Shake", nullptr
-};
+const char* econstr_names[econtNR + 1] = { "Lincs", "Shake", nullptr };
-const char *eintmod_names[eintmodNR+1] = {
- "Potential-shift-Verlet", "Potential-shift", "None", "Potential-switch", "Exact-cutoff", "Force-switch", nullptr
+const char* eintmod_names[eintmodNR + 1] = {
+ "Potential-shift-Verlet", "Potential-shift", "None", "Potential-switch",
+ "Exact-cutoff", "Force-switch", nullptr
};
-const char *etcoupl_names[etcNR+1] = {
+const char* etcoupl_names[etcNR + 1] = {
"No", "Berendsen", "Nose-Hoover", "yes", "Andersen", "Andersen-massive", "V-rescale", nullptr
}; /* yes is alias for berendsen */
-const char *epcoupl_names[epcNR+1] = {
+const char* epcoupl_names[epcNR + 1] = {
"No", "Berendsen", "Parrinello-Rahman", "Isotropic", "MTTK", nullptr
}; /* isotropic is alias for berendsen */
-const char *epcoupltype_names[epctNR+1] = {
- "Isotropic", "Semiisotropic", "Anisotropic", "Surface-Tension", nullptr
-};
+const char* epcoupltype_names[epctNR + 1] = { "Isotropic", "Semiisotropic", "Anisotropic",
+ "Surface-Tension", nullptr };
-const char *edisre_names[edrNR+1] = {
- "No", "Simple", "Ensemble", nullptr
-};
+const char* edisre_names[edrNR + 1] = { "No", "Simple", "Ensemble", nullptr };
-const char *edisreweighting_names[edrwNR+1] = {
- "Conservative", "Equal", nullptr
-};
+const char* edisreweighting_names[edrwNR + 1] = { "Conservative", "Equal", nullptr };
-const char *enbf_names[eNBF_NR+1] = {
- "", "LJ", "Buckingham", nullptr
-};
+const char* enbf_names[eNBF_NR + 1] = { "", "LJ", "Buckingham", nullptr };
-const char *ecomb_names[eCOMB_NR+1] = {
- "", "Geometric", "Arithmetic", "GeomSigEps", nullptr
-};
+const char* ecomb_names[eCOMB_NR + 1] = { "", "Geometric", "Arithmetic", "GeomSigEps", nullptr };
-const char *esimtemp_names[esimtempNR+1] = {
- "geometric", "exponential", "linear", nullptr
-};
+const char* esimtemp_names[esimtempNR + 1] = { "geometric", "exponential", "linear", nullptr };
-const char *efep_names[efepNR+1] = {
- "no", "yes", "static", "slow-growth", "expanded", nullptr
-};
+const char* efep_names[efepNR + 1] = { "no", "yes", "static", "slow-growth", "expanded", nullptr };
-const char *efpt_names[efptNR+1] = {
- "fep-lambdas", "mass-lambdas", "coul-lambdas", "vdw-lambdas", "bonded-lambdas", "restraint-lambdas", "temperature-lambdas", nullptr
-};
+const char* efpt_names[efptNR + 1] = { "fep-lambdas", "mass-lambdas", "coul-lambdas",
+ "vdw-lambdas", "bonded-lambdas", "restraint-lambdas",
+ "temperature-lambdas", nullptr };
-const char *efpt_singular_names[efptNR+1] = {
- "fep-lambda", "mass-lambda", "coul-lambda", "vdw-lambda", "bonded-lambda", "restraint-lambda", "temperature-lambda", nullptr
-};
+const char* efpt_singular_names[efptNR + 1] = { "fep-lambda", "mass-lambda",
+ "coul-lambda", "vdw-lambda",
+ "bonded-lambda", "restraint-lambda",
+ "temperature-lambda", nullptr };
-const char *edHdLPrintEnergy_names[edHdLPrintEnergyNR+1] = {
- "no", "total", "potential", "yes", nullptr
-};
+const char* edHdLPrintEnergy_names[edHdLPrintEnergyNR + 1] = { "no", "total", "potential", "yes", nullptr };
-const char *elamstats_names[elamstatsNR+1] = {
- "no", "metropolis-transition", "barker-transition", "minvar", "wang-landau", "weighted-wang-landau", nullptr
+const char* elamstats_names[elamstatsNR + 1] = {
+ "no", "metropolis-transition", "barker-transition",
+ "minvar", "wang-landau", "weighted-wang-landau",
+ nullptr
};
-const char *elmcmove_names[elmcmoveNR+1] = {
- "no", "metropolis", "barker", "gibbs", "metropolized-gibbs", nullptr
-};
+const char* elmcmove_names[elmcmoveNR + 1] = { "no", "metropolis", "barker",
+ "gibbs", "metropolized-gibbs", nullptr };
-const char *elmceq_names[elmceqNR+1] = {
- "no", "yes", "wl-delta", "number-all-lambda", "number-steps", "number-samples", "count-ratio", nullptr
-};
+const char* elmceq_names[elmceqNR + 1] = { "no", "yes",
+ "wl-delta", "number-all-lambda",
+ "number-steps", "number-samples",
+ "count-ratio", nullptr };
-const char *separate_dhdl_file_names[esepdhdlfileNR+1] = {
- "yes", "no", nullptr
-};
+const char* separate_dhdl_file_names[esepdhdlfileNR + 1] = { "yes", "no", nullptr };
-const char *dhdl_derivatives_names[edhdlderivativesNR+1] = {
- "yes", "no", nullptr
-};
+const char* dhdl_derivatives_names[edhdlderivativesNR + 1] = { "yes", "no", nullptr };
-const char *esol_names[esolNR+1] = {
- "No", "SPC", "TIP4p", nullptr
-};
+const char* esol_names[esolNR + 1] = { "No", "SPC", "TIP4p", nullptr };
-const char *edispc_names[edispcNR+1] = {
- "No", "EnerPres", "Ener", "AllEnerPres", "AllEner", nullptr
-};
+const char* edispc_names[edispcNR + 1] = { "No", "EnerPres", "Ener",
+ "AllEnerPres", "AllEner", nullptr };
-const char *ecm_names[ecmNR+1] = {
- "Linear", "Angular", "None", "Linear-acceleration-correction", nullptr
-};
+const char* ecm_names[ecmNR + 1] = { "Linear", "Angular", "None", "Linear-acceleration-correction", nullptr };
-const char *eann_names[eannNR+1] = {
- "No", "Single", "Periodic", nullptr
-};
+const char* eann_names[eannNR + 1] = { "No", "Single", "Periodic", nullptr };
-const char *ewt_names[ewtNR+1] = {
- "9-3", "10-4", "table", "12-6", nullptr
-};
+const char* ewt_names[ewtNR + 1] = { "9-3", "10-4", "table", "12-6", nullptr };
-const char *epull_names[epullNR+1] = {
- "umbrella", "constraint", "constant-force", "flat-bottom", "flat-bottom-high", "external-potential", nullptr
-};
+const char* epull_names[epullNR + 1] = { "umbrella", "constraint", "constant-force",
+ "flat-bottom", "flat-bottom-high", "external-potential",
+ nullptr };
-const char *epullg_names[epullgNR+1] = {
- "distance", "direction", "cylinder", "direction-periodic", "direction-relative", "angle", "dihedral", "angle-axis", nullptr
-};
+const char* epullg_names[epullgNR + 1] = { "distance", "direction", "cylinder",
+ "direction-periodic", "direction-relative", "angle",
+ "dihedral", "angle-axis", nullptr };
-const char *erotg_names[erotgNR+1] = {
- "iso", "iso-pf", "pm", "pm-pf", "rm", "rm-pf", "rm2", "rm2-pf", "flex", "flex-t", "flex2", "flex2-t", nullptr
-};
+const char* erotg_names[erotgNR + 1] = { "iso", "iso-pf", "pm", "pm-pf", "rm",
+ "rm-pf", "rm2", "rm2-pf", "flex", "flex-t",
+ "flex2", "flex2-t", nullptr };
-const char *erotg_fitnames[erotgFitNR+1] = {
- "rmsd", "norm", "potential", nullptr
-};
+const char* erotg_fitnames[erotgFitNR + 1] = { "rmsd", "norm", "potential", nullptr };
-const char *eSwapTypes_names[eSwapTypesNR+1] = {
- "no", "X", "Y", "Z", nullptr
-};
+const char* eSwapTypes_names[eSwapTypesNR + 1] = { "no", "X", "Y", "Z", nullptr };
-const char *eSwapFixedGrp_names[eSwapFixedGrpNR+1] = {
- "Split0", "Split1", "Solvent", nullptr
-};
+const char* eSwapFixedGrp_names[eSwapFixedGrpNR + 1] = { "Split0", "Split1", "Solvent", nullptr };
-const char *eQMmethod_names[eQMmethodNR+1] = {
- "AM1", "PM3", "RHF",
- "UHF", "DFT", "B3LYP", "MP2", "CASSCF", "B3LYPLAN",
- "DIRECT", nullptr
-};
+const char* eQMmethod_names[eQMmethodNR + 1] = { "AM1", "PM3", "RHF", "UHF",
+ "DFT", "B3LYP", "MP2", "CASSCF",
+ "B3LYPLAN", "DIRECT", nullptr };
-const char *eQMbasis_names[eQMbasisNR+1] = {
- "STO3G", "STO-3G", "3-21G",
- "3-21G*", "3-21+G*", "6-21G",
- "6-31G", "6-31G*", "6-31+G*",
- "6-311G", nullptr
-};
+const char* eQMbasis_names[eQMbasisNR + 1] = { "STO3G", "STO-3G", "3-21G", "3-21G*",
+ "3-21+G*", "6-21G", "6-31G", "6-31G*",
+ "6-31+G*", "6-311G", nullptr };
-const char *eQMMMscheme_names[eQMMMschemeNR+1] = {
- "normal", "ONIOM", nullptr
-};
+const char* eQMMMscheme_names[eQMMMschemeNR + 1] = { "normal", "ONIOM", nullptr };
-const char *gmx_nblist_geometry_names[GMX_NBLIST_GEOMETRY_NR+1] = {
- "Particle-Particle", "Water3-Particle", "Water3-Water3", "Water4-Particle", "Water4-Water4", "CG-CG", nullptr
+const char* gmx_nblist_geometry_names[GMX_NBLIST_GEOMETRY_NR + 1] = {
+ "Particle-Particle", "Water3-Particle", "Water3-Water3", "Water4-Particle",
+ "Water4-Water4", "CG-CG", nullptr
};
-const char *gmx_nblist_interaction_names[GMX_NBLIST_INTERACTION_NR+1] = {
- "Standard", "Free_Energy", nullptr
-};
+const char* gmx_nblist_interaction_names[GMX_NBLIST_INTERACTION_NR + 1] = { "Standard",
+ "Free_Energy", nullptr };
-const char *gmx_nbkernel_elec_names[GMX_NBKERNEL_ELEC_NR+1] =
-{
+const char* gmx_nbkernel_elec_names[GMX_NBKERNEL_ELEC_NR + 1] = {
"None", "Coulomb", "Reaction-Field", "Cubic-Spline-Table", "Ewald", nullptr
};
-const char *gmx_nbkernel_vdw_names[GMX_NBKERNEL_VDW_NR+1] =
-{
- "None", "Lennard-Jones", "Buckingham", "Cubic-Spline-Table", "LJEwald", nullptr
-};
+const char* gmx_nbkernel_vdw_names[GMX_NBKERNEL_VDW_NR + 1] = { "None", "Lennard-Jones",
+ "Buckingham", "Cubic-Spline-Table",
+ "LJEwald", nullptr };
biod.pnpi.spb.ru / alexxy / gromacs.git / blobdiff