Unverified Commit d01b0ed5 authored by Axel Kohlmeyer's avatar Axel Kohlmeyer Committed by GitHub
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Merge pull request #1882 from agiliopadua/docs

Convert documentation of compute_fep, pair_fep_soft, pair_nm to mathjax
parents 5d467bcc 0e2604fc
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doc/src/Eqs/compute_fep_bar.jpg

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doc/src/Eqs/compute_fep_bar.tex

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\documentstyle[12pt]{article}

\begin{document}

\[ \left< \frac{1}{1 + \exp\left[\left(U_1 - U_0 - \Delta_0^1A \right) /kT \right]} \right>_0 = \left< \frac{1}{1 + \exp\left[\left(U_0 - U_1 + \Delta_0^1A \right) /kT \right]} \right>_1 \]

\end{document}

doc/src/Eqs/compute_fep_fdti.jpg

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doc/src/Eqs/compute_fep_fdti.tex

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\documentstyle[12pt]{article}

\begin{document}

\[ \Delta_0^1 A = \int_{\lambda=0}^{\lambda=1} \left( \frac{\partial
    A(\lambda)}{\partial\lambda} \right)_\lambda \mathrm{d}\lambda
\approx \sum_{i=0}^{n-1} w_i \frac{A(\lambda_{i} + \delta) -
  A(\lambda_i)}{\delta} \]

\end{document}

doc/src/Eqs/compute_fep_fep.jpg

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