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Fix typo
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HanatoK committed May 30, 2024
1 parent 74e31cc commit 7b1cad4
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion src/colvarcomp_pucker.cpp
Original file line number Diff line number Diff line change
Expand Up @@ -121,7 +121,7 @@ cpABC calc_cpABC(const cvm::atom_group& r, cpABC_grad* grad = nullptr) {
one_denom_sq * (dtriple_dz * denominator - dnorm_dz * triples[k])};
grad->dA_dr[j] += sin_f2[k] * dzk_drj;
grad->dB_dr[j] += cos_f2[k] * dzk_drj;
grad->dB_dr[j] += ((-2.0) * (k % 2) + 1.0) * dzk_drj;
grad->dC_dr[j] += ((-2.0) * (k % 2) + 1.0) * dzk_drj;
}
}
}
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