From 4b02eb259e21e8b61527c1199a9ca1ffafe36cca Mon Sep 17 00:00:00 2001 From: --unset Date: Tue, 10 Mar 2026 07:59:59 -0400 Subject: [PATCH] updating with volume, issue, page numbers --- README.md | 7 +++---- docs/source/Citation.rst | 7 +++---- molSimplify/Classes/globalvars.py | 2 +- 3 files changed, 7 insertions(+), 9 deletions(-) diff --git a/README.md b/README.md index f545d18c..501ec280 100644 --- a/README.md +++ b/README.md @@ -125,10 +125,9 @@ year = {2018}, @Article{molSimplify2.0, author = {Terrones, Gianmarco G. and St. Michel, Roland G. and Toney, Jacob W. and Ball, Akash K. and Wang, Yiran and Garrison, Aaron G. and Nandy, Aditya and Meyer, Ralf and Edholm, Freya and Oh, Changhwan and Pujet, Sebastian G. and Chu, Daniel B. K. and Muhammetgulyyev, Davut and Kulik, Heather J.}, title = {molSimplify 2.0: Improved Structure Generation for Automating Discovery in Inorganic Molecular and Reticular Chemistry}, -volume = {XXX}, -number = {XXX}, -pages = {XXX-XXX}, -issn = {XXX-XXX}, +volume = {66}, +number = {5}, +pages = {2753-2767}, url = {https://doi.org/10.1021/acs.jcim.5c02733}, doi = {10.1021/acs.jcim.5c02733}, year = {2026}, diff --git a/docs/source/Citation.rst b/docs/source/Citation.rst index bdc33165..a1be6bf1 100644 --- a/docs/source/Citation.rst +++ b/docs/source/Citation.rst @@ -41,10 +41,9 @@ Structure Generation @Article{molSimplify2.0, author = {Terrones, Gianmarco G. and St. Michel, Roland G. and Toney, Jacob W. and Ball, Akash K. and Wang, Yiran and Garrison, Aaron G. and Nandy, Aditya and Meyer, Ralf and Edholm, Freya and Oh, Changhwan and Pujet, Sebastian G. and Chu, Daniel B. K. and Muhammetgulyyev, Davut and Kulik, Heather J.}, title = {molSimplify 2.0: Improved Structure Generation for Automating Discovery in Inorganic Molecular and Reticular Chemistry}, - volume = {XXX}, - number = {XXX}, - pages = {XXX-XXX}, - issn = {XXX-XXX}, + volume = {66}, + number = {5}, + pages = {2753-2767}, url = {https://doi.org/10.1021/acs.jcim.5c02733}, doi = {10.1021/acs.jcim.5c02733}, year = {2026}, diff --git a/molSimplify/Classes/globalvars.py b/molSimplify/Classes/globalvars.py index ef36138c..9a67667a 100644 --- a/molSimplify/Classes/globalvars.py +++ b/molSimplify/Classes/globalvars.py @@ -650,7 +650,7 @@ def __init__(self): E.I. Ioannidis, T.Z.H. Gani, H.J. Kulik. J. Comput. Chem. 2016, 37, 2106-2117. J.P. Janet, Q. Zhao, E.I. Ioannidis, H.J. Kulik. Mol. Simul. 2017, 43(5-6), 327-345. J.P. Janet, T.Z.H. Gani, A.H. Steeves, E.I. Ioannidis, H.J. Kulik. Ind. Eng. Chem. Res. 2017, 56(17), 4898-4910. -G.G. Terrones, R.G. St. Michel, J.W. Toney, A.K. Ball, Y. Wang, A.G. Garrison, A. Nandy, R. Meyer, F. Edholm, C. Oh, S.G. Pujet, D.B.K. Chu, D. Muhammetgulyyev, H.J. Kulik. J. Chem. Inf. Model. 2026, XXX, XXX-XXX. +G.G. Terrones, R.G. St. Michel, J.W. Toney, A.K. Ball, Y. Wang, A.G. Garrison, A. Nandy, R. Meyer, F. Edholm, C. Oh, S.G. Pujet, D.B.K. Chu, D. Muhammetgulyyev, H.J. Kulik. J. Chem. Inf. Model. 2026, 66(5), 2753-2767. For an extended list of references, please see https://molsimplify.readthedocs.io/en/latest/Citation.html '''.rstrip('\n')