From 0738573158a4260bc64e1d5cf037b387017019d5 Mon Sep 17 00:00:00 2001 From: Jigyasa Nigam Date: Thu, 15 Oct 2020 18:58:40 +0200 Subject: [PATCH] Update README.rst --- README.rst | 18 +++++++++--------- 1 file changed, 9 insertions(+), 9 deletions(-) diff --git a/README.rst b/README.rst index 22b49c0..4d501f7 100644 --- a/README.rst +++ b/README.rst @@ -4,13 +4,13 @@ NICE ==== -NICE (N-body Iteratively Contracted Equivariants) is a set of tools designed for calculation of -invariant and covariant atomic structure representations. It allows to -automatically select most informative combinations of high order spectrum elements -and perform their efficient computation using recurrence relations. +NICE (N-body Iteratively Contracted Equivariants) is a set of tools designed for the calculation of +invariant and covariant atomic structure representations. It allows for +automatic selection of the most informative combinations of high order spectrum elements +and performs their efficient computation using recurrence relations. -Though being designed specifically for atomistic machine learning, NICE in principle -can be applied to other machine learning tasks which involves signals in a ball or on a sphere with necessasity to produce invariant or covariant output. +Although it is designed specifically for atomistic machine learning, NICE in principle +can be applied to other machine learning tasks, such as those which involve signals in a ball or on a sphere, all which require invariant or covariant outputs. ++++++++++++ Installation @@ -24,12 +24,12 @@ Installation Documentation +++++++++++++ -Documentation is `here `_ +Documentation can be found `here `_ ++++++++++ References ++++++++++ -If you are using NICE please cite `this article `_. +If you are using NICE, please cite `this article `_. -[1] Nigam, Jigyasa, Sergey Pozdnyakov, and Michele Ceriotti. "Recursive evaluation and iterative contraction of N-body equivariant features." The Journal of Chemical Physics 153.12 (2020): 121101. +[1] Jigyasa Nigam, Sergey Pozdnyakov, and Michele Ceriotti. "Recursive evaluation and iterative contraction of N-body equivariant features." The Journal of Chemical Physics 153.12 (2020): 121101.