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update formatting style to be more consistent

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This commit is contained in:
Axel Kohlmeyer
2020-09-21 01:58:27 -04:00
parent 0a11cc5eb9
commit 29a7d598ac
53 changed files with 108 additions and 108 deletions
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36
src/molecule.cpp
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@ -492,7 +492,7 @@ void Molecule::read(int flag)
if (nmatch != nwant)
error->one(FLERR,"Invalid header in molecule file");
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid header in molecule file\n"
"{}", e.what()));
}
@ -688,7 +688,7 @@ void Molecule::coords(char *line)
x[i][1] *= sizescale;
x[i][2] *= sizescale;
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Coords section in molecule file\n"
"{}", e.what()));
}
@ -718,7 +718,7 @@ void Molecule::types(char *line)
type[i] = values.next_int();
type[i] += toffset;
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Types section in molecule file\n"
"{}", e.what()));
}
@ -748,7 +748,7 @@ void Molecule::molecules(char *line)
molecule[i] = values.next_int();
// molecule[i] += moffset; // placeholder for possible molecule offset
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Molecules section in molecule file\n"
"{}", e.what()));
}
@ -785,7 +785,7 @@ void Molecule::fragments(char *line)
fragmentmask[i][atomID-1] = 1;
}
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid atom ID in Fragments section of molecule file\n"
"{}", e.what()));
}
@ -807,7 +807,7 @@ void Molecule::charges(char *line)
values.next_int();
q[i] = values.next_double();
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Charges section in molecule file\n"
"{}", e.what()));
}
@ -833,7 +833,7 @@ void Molecule::diameters(char *line)
radius[i] *= 0.5;
maxradius = MAX(maxradius,radius[i]);
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Diameters section in molecule file\n"
"{}", e.what()));
}
@ -860,7 +860,7 @@ void Molecule::masses(char *line)
rmass[i] = values.next_double();
rmass[i] *= sizescale*sizescale*sizescale;
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Masses section in molecule file\n"
"{}", e.what()));
}
@ -898,7 +898,7 @@ void Molecule::bonds(int flag, char *line)
itype = values.next_int();
atom1 = values.next_tagint();
atom2 = values.next_tagint();
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Bonds section in molecule file\n"
"{}", e.what()));
}
@ -967,7 +967,7 @@ void Molecule::angles(int flag, char *line)
atom1 = values.next_tagint();
atom2 = values.next_tagint();
atom3 = values.next_tagint();
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Angles section in molecule file\n"
"{}", e.what()));
}
@ -1052,7 +1052,7 @@ void Molecule::dihedrals(int flag, char *line)
atom2 = values.next_tagint();
atom3 = values.next_tagint();
atom4 = values.next_tagint();
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Dihedrals section in molecule file\n"
"{}", e.what()));
}
@ -1152,7 +1152,7 @@ void Molecule::impropers(int flag, char *line)
atom2 = values.next_tagint();
atom3 = values.next_tagint();
atom4 = values.next_tagint();
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Impropers section in molecule file\n"
"{}", e.what()));
}
@ -1244,7 +1244,7 @@ void Molecule::nspecial_read(int flag, char *line)
c1 = values.next_tagint();
c2 = values.next_tagint();
c3 = values.next_tagint();
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Special Bond Counts section in molecule file\n"
"{}", e.what()));
}
@ -1283,7 +1283,7 @@ void Molecule::special_read(char *line)
error->one(FLERR,"Invalid special atom index in molecule file");
}
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Molecule file special list\n"
"{}", e.what()));
}
@ -1415,7 +1415,7 @@ void Molecule::shakeflag_read(char *line)
values.next_int();
shake_flag[i] = values.next_int();
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid Shake Flags section in molecule file\n"
"{}", e.what()));
}
@ -1480,7 +1480,7 @@ void Molecule::shakeatom_read(char *line)
error->one(FLERR,"Invalid shake atom in molecule file");
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR,fmt::format("Invalid shake atom in molecule file\n"
"{}", e.what()));
}
@ -1545,7 +1545,7 @@ void Molecule::shaketype_read(char *line)
if (nmatch != nwant)
error->one(FLERR,"Invalid shake type data in molecule file");
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid shake type data in molecule file\n",
"{}", e.what()));
}
@ -1598,7 +1598,7 @@ void Molecule::body(int flag, int pflag, char *line)
}
} else nword += ncount;
}
} catch (TokenizerException & e) {
} catch (TokenizerException &e) {
error->one(FLERR, fmt::format("Invalid body params in molecule file\n",
"{}", e.what()));
}