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Graeme M. Day

university of southampton

68H指数
496论文数
1.5W被引数
收录论文 105
发表时间
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A permanently porous chalcogen-bonded organic framework永久性多孔的硫属键合有机框架
errNature Synthesis
IF20
err2026-05-15
err0
PREAI
errBrian J. Eckstein; Hannah R. Martin; Michael P. Moghadasnia; Arijit Halder; Parker S. Brodale; Pierre Le Magueres; Patrick W. V. Butler; Katherine A. Forrest; Logan Ritter; Ryan A. Klein; Hyun June Moon; Cheng Li; Scott E. Massimi; Yongqiang Cheng; Christopher H. Hendon; Graeme M. Day; Brian Space; Craig M. Brown; C. Michael McGuirk
err分享
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The elusive endo-product of the archetypal Diels-Alder reaction of furan and maleic anhydride – observed in the solid state at last呋喃与马来酸酐典型狄尔斯-阿尔德反应中难以捉摸的endo产物——终于观察到其固态形态
errchem. sci.
IF0
err2026-05-14
err0
errOAAI
errCameron B. Lennox; Christopher Taylor; Igor Huskić; Jogirdas Vainauskas; Christopher Nickels; Robin S Stein; Tristan H Borchers; A.R. Bonnie J. Lutton Gething; Joseph M Marrett; Graeme Matthew Day; Tomislav Friščić
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Can Machine Learning Predict the Space Group Preference of Organic Molecules?机器学习能否预测有机分子的空间群偏好？
errCrystal Growth & Design
IF0
err2026-04-16
err0
errOAAI
errHannah Gittins; Graeme M. Day
err分享
err收藏
From Crystal Structure Prediction to Polymorphic Behaviour: Monte Carlo Threshold Mapping of Crystal Energy Landscapes从晶体结构预测到多晶型行为：晶体能量景观的蒙特卡罗阈值映射
errchem. sci.
IF0
err2026-01-12
err0
errOAAI
errPedro Juan-Royo; Graeme Matthew Day
err分享
err收藏
Crystal Structure Prediction for Aprotic Ionic Liquids - Searching for the Unknown非质子离子液体的晶体结构预测——探索未知
errCrystal Growth & Design
IF0
err2026-01-01
err0
errOAAI
errTous, Petr; Day, Graeme M.; Cervinka, Ctirad
err分享
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Exploring organic chemical space for materials discovery using crystal structure prediction-informed evolutionary optimisation探索基于晶体结构预测指导的进化优化方法，用于有机化学空间中的材料发现
errNature Communications
IF15.7
err2025-11-26
err0
errOAAI
errJay Johal; Graeme M. Day
err分享
err收藏
An Adapted Similarity Kernel and Generalized Convex Hull for Molecular Crystal Structure Prediction一种自适应相似性核与广义凸包用于分子晶体结构预测
errCrystal Growth & Design
IF3.4
err2025-10-23
err0
errOAAI
errJennie Martin; Michele Ceriotti; Graeme M. Day
err分享
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Polar Triptycene-Based Nonmetal Organic Frameworks Show Enhanced Hydrogen Adsorption极性三联苯基非金属有机框架显示出增强的氢吸附性能
errJournal of the American Chemical Society
IF15.6
err2025-10-16
err0
errOAAI
errMegan O’Shaughnessy; Hang Qu; Xue Wang; Jacob B. Holmes; Lyndon Emsley; Joseph Glover; Roohollah Hafizi; Graeme M. Day; Andrew I. Cooper
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Nonmetal Organic Frameworks Exhibit High Proton Conductivity非金属有机骨架表现出高质子导电性
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2025-04-24
err0
errOAAI
errO'Shaughnessy, Megan; Lim, Jungwoo; Glover, Joseph; Neale, Alex R.; Day, Graeme M.; Hardwick, Laurence J.; Cooper, Andrew I.
err分享
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Discovering synthesis targets: general discussion
errFARADAY DISCUSSIONS
IF3.1
err2025-01-01
err0
PREAI
errAnker, Andy S.; Aspuru-Guzik, Alan; Bechtel, Tim; Bigi, Filippo; Briling, Ksenia R.; Das, Basita; David, Nicholas; Day, Graeme M.; Deringer, Volker L.; Dyer, Matthew; Eardley-Brunt, Annabel; Evans, Matthew L.; Evans, Rob; Franklin, Barnabas A.; Ganose, Alex M.; George, Janine; Goulding, Mark; Hickey, Niamh; James, Gillian; Kalikadien, Adarsh V.; Kapil, Venkat; Kulik, Heather J.; Kumar, Vishank; Kuttner, Christian; Lam, Erwin; Lederbauer, Magdalena; Lou, Yuchen; Martin, Jennie; Bran, Andres Marulanda; Mathea, Miriam; Pickard, Chris J.; Ruscic, Branko; Ryder, Matthew R.; Gil, Victor Sabanza; Schwaller, Philippe; Segler, Marwin H. S.; Sun, Wenhao; Tanovic, Sara; Treyde, Wojtek; Walsh, Aron; Wu, Ruiqi
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Predictive crystallography at scale: mapping, validating, and learning from 1000 crystal energy landscapes
errFARADAY DISCUSSIONS
IF3.1
err2025-01-01
err1
errOAAI
errTaylor, Christopher R.; Butler, Patrick W. V.; Day, Graeme M.
err分享
err收藏
Discovering chemical structure: general discussion
errFARADAY DISCUSSIONS
IF3.1
err2025-01-01
err0
PREAI
errAspuru-Guzik, Alan; Bechtel, Tim; Bernales, Varinia; Biggin, Philip C.; Bigi, Filippo; Borges Jr, Itamar; Briling, Ksenia R.; Cheung, Joshua; Collins, Christopher M.; Darmawan, Kevion K.; David, Nicholas; Day, Graeme M.; Deringer, Volker L.; Draxl, Claudia; Dyer, Matthew; Eardley-Brunt, Annabel; Evans, Rob; Fairlamb, Ian; Franklin, Barnabas A.; George, Janine; Goulding, Mark; Grundy, Joanna; Hafizi, Roohollah; Hakkennes, Matthijs; Hickey, Niamh; James, Gillian; Juraskova, Veronika; Kalikadien, Adarsh V.; Kapil, Venkat; Kulik, Heather J.; Kumar, Vishank; Kuttner, Christian; Lederbauer, Magdalena; Lou, Yuchen; Mante, Eltjo; Marsh, Liam; Martin, Jennie; Middleton, Clelia; Nematiaram, Tahereh; Pare, Charles W. P.; Pasca, Bianca; Pickard, Chris J.; Ruscic, Branko; Ryder, Matthew R.; Savoie, Brett M.; Sun, Wenhao; Szczypinski, Filip T.; Taniguchi, Takuya; Torrisi, Steven; Vishnoi, Shubham; Walsh, Aron; Wang, Shirui
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Discovering trends in big data: general discussion
errFARADAY DISCUSSIONS
IF3.1
err2025-01-01
err0
PREAI
errAlbornoz, Ricardo Valencia; Antypov, Dmytro; Blanke, Gerd; Borges Jr, Itamar; Bran, Andres Marulanda; Cheung, Joshua; Collins, Christopher M.; David, Nicholas; Day, Graeme M.; Deringer, Volker L.; Draxl, Claudia; Eardley-Brunt, Annabel; Evans, Matthew L.; Fairlamb, Ian; Fieseler, Kate; Franklin, Barnabas A.; George, Janine; Grundy, Joanna; Johal, Jay; Kalikadien, Adarsh V.; Kapil, Venkat; Kotopanov, Lyubomir; Kumar, Vishank; Kuttner, Christian; Lederbauer, Magdalena; Ojeda-Porras, Andrea Carolina; Pang, Jiayun; Parkes, Michael; Pemberton, Miles; Ruscic, Branko; Ryder, Matthew R.; Sakaushi, Ken; Saleh, Gabriele; Savoie, Brett M.; Schwaller, Philippe; Skjelstad, Bastian Bjerkem; Sun, Wenhao; Taniguchi, Takuya; Taylor, Christopher R.; Torrisi, Steven; Vishnoi, Shubham; Walsh, Aron; Wu, Ruiqi
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The influence of the crystal sponge framework on guest molecule conformation晶格海绵框架对客体分子构象的影响
errCRYSTENGCOMM
IF2.6
err2025-01-01
err0
errOAAI
errSoper, Eleanor M.; Coles, Simon J.; Day, Graeme M.
err分享
err收藏
Discovering structure-property correlations: general discussion
errFARADAY DISCUSSIONS
IF3.1
err2025-01-01
err0
PREAI
errAnker, Andy S.; Aspuru-Guzik, Alan; Ben Mahmoud, Chiheb; Bennett, Sophie; Briling, Ksenia R.; Changiarath, Arya; Chong, Sanggyu; Collins, Christopher M.; Cooper, Andrew I.; Crusius, Daniel; Darmawan, Kevion K.; Das, Basita; David, Nicholas; Day, Graeme M.; Deringer, Volker L.; Duarte, Fernanda; Eardley-Brunt, Annabel; Evans, Matthew L.; Evans, Rob; Fairlamb, Ian; Franklin, Barnabas A.; Frey, Jeremy; Ganose, Alex M.; Goulding, Mark; Hafizi, Roohollah; Hakkennes, Matthijs; Hickey, Niamh; James, Gillian; Jelfs, Kim E.; Kalikadien, Adarsh V.; Kapil, Venkat; Koczor-Benda, Zsuzsanna; Krammer, Ferdinand; Kulik, Heather J.; Kumar, Vishank; Kuttner, Christian; Lam, Erwin; Lou, Yuchen; Mante, Eltjo; Martin, Jennie; Mroz, Austin M.; Nematiaram, Tahereh; Pare, Charles W. P.; Patra, Sarbani; Proudfoot, James; Ruscic, Branko; Ryder, Matthew R.; Sakaushi, Ken; Sassmannshausen, Joerg; Savoie, Brett M.; Schneider, Nadine; Schwaller, Philippe; Skjelstad, Bastian Bjerkem; Sun, Wenhao; Szczypinski, Filip T.; Torrisi, Steven; Ueltzen, Katharina; Vishnoi, Shubham; Walsh, Aron; Wang, Xinwei; Wilson, Chloe; Wu, Ruiqi; Zeitler, Jakob
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Computationally guided synthesis of a hierarchical [4[2+3]+6] porous organic 'cage of cages'
errNATURE SYNTHESIS
IF20
err2024-04-26
err8
errOAAI
errZhu, Qiang; Qu, Hang; Avci, Gokay; Hafizi, Roohollah; Zhao, Chengxi; Day, Graeme M.; Jelfs, Kim E.; Little, Marc A.; Cooper, Andrew I.
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Exploring Polymorphism: Hydrochloride Salts of Pitolisant and Analogues探索多态性: Pitolisant和类似物的盐酸盐
errCRYSTAL GROWTH & DESIGN
IF3.4
err2024-01-23
err0
PREAI
errPatel, Jessica; Leduc, Zachary; Nunez Avila, Aaron Gabriel; Glover, Joseph A.; Wu, Kelin; Zhang, Yuxing; Zhang, Jing; Zhai, Xiaoting; Jing, Huize; Chen, Alex M.; Chartrand, Daniel; Maris, Thierry; Day, Graeme M.; Wuest, James D.
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Modular, multi-robot integration of laboratories: an autonomous workflow for solid-state chemistry
errCHEMICAL SCIENCE
IF7.4
err2024-01-01
err20
errOAAI
errLunt, Amy. M.; Fakhruldeen, Hatem; Pizzuto, Gabriella; Longley, Louis; White, Alexander; Rankin, Nicola; Clowes, Rob; Alston, Ben; Gigli, Lucia; Day, Graeme M.; Cooper, Andrew I.; Chong, Samantha Y.
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Pushing Technique Boundaries to Probe Conformational Polymorphism
errCRYSTAL GROWTH & DESIGN
IF3.4
err2023-08-30
err6
errOAAI
errWard, Martin R.; Taylor, Christopher R.; Mulvee, Matthew T.; Lampronti, Giulio I.; Belenguer, Ana M.; Steed, Jonathan W.; Day, Graeme M.; Oswald, Iain D. H.
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Crystal Structure Prediction of Energetic Materials
errCRYSTAL GROWTH & DESIGN
IF3.4
err2023-07-17
err12
errOAAI
errArnold, Joseph E. E.; Day, Graeme M. M.
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研究方向

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合作学者
合作期刊
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Jean‐Luc Brédas
H 指数: 151 · 论文数: 1.5K
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H 指数: 134 · 论文数: 834
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H 指数: 126 · 论文数: 985
Feihe Huang 封面图
Feihe Huang (Feihe Huang)
H 指数: 124 · 论文数: 754
A
Alán Aspuru‐Guzik
H 指数: 114 · 论文数: 936
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