Search results for "chemistry"

Hits ?▲	Authors	Title	Venue	Year	Link
12	Ella Gale, Leo Lobski, Fabio Zanasi	A Categorical Approach to Synthetic Chemistry.	ICTAC	2023	DBLP DOI BibTeX RDF
12	Mohammad Sajjad Ghaemi, Hang Hu 0017, Anguang Hu, Hsu Kiang Ooi	bfCHA2: CHemistry Aware Convex Hull Autoencoder Towards Inverse Molecular Design.	KI	2023	DBLP DOI BibTeX RDF
12	Elliot Hu-Au, Pooja Addla, Janani Harinarayanan, Zhanlan Wei, Chuhe Wu, Zoey Yichen Liu, Mara Danoff	Novel Behaviors of Youth in a Virtual Reality Chemistry Lab.	iLRN	2023	DBLP DOI BibTeX RDF
12	Feng Qiu, Pu Ji, Baojian Hua, Yang Wang	CHEMFUZZ: Large Language Models-Assisted Fuzzing for Quantum Chemistry Software Bug Detection.	QRS Companion	2023	DBLP DOI BibTeX RDF
12	Honelly Mae Segui Cascolan	The Effect of Flipped Classroom Environment on Academic Achievement, Self-efficacy and Metacognitive Awareness of Students towards Chemistry.	IC4E	2023	DBLP DOI BibTeX RDF
12	Soraya, Jaslin Ikhsan, Muhamad Ikhsan Sahal Guntur, Roza Maiyarni	Assessing Chemistry Virtual Laboratory and Its Impact in the Learning Process.	ICEMT	2023	DBLP DOI BibTeX RDF
12	Peter Love	Q-CASA Keynote Speaker Quantum Simulation from Quantum Chemistry to Quantum Field Theory.	IPDPS Workshops	2023	DBLP DOI BibTeX RDF
12	Suyash Gupta, Mohammad Javad Amiri, Mohammad Sadoghi	Chemistry behind Agreement.	CIDR	2023	DBLP BibTeX RDF
12	Satoki Tsuji, Yasuaki Ito, Koji Nakano, Akihiko Kasagi	Efficient GPU-Accelerated Bulk Evaluation of the Boys Function for Quantum Chemistry.	candar	2023	DBLP DOI BibTeX RDF
12	Simon J. Hickinbotham	Drivers of Replicator Organisation in the Nanopond Artificial Chemistry.	GECCO Companion	2023	DBLP DOI BibTeX RDF
12	Waheeda Saib, Xavier Bonet-Monroig, Vedran Dunjko, Ivano Tavernelli, Thomas Bäck, Hao Wang 0025	Benchmarking Adaptive Quantum Circuit Optimization Algorithms for Quantum Chemistry.	QCE	2023	DBLP DOI BibTeX RDF
12	Shah Ishmam Mohtashim, Sheikh Mahatabuddin, Md. Abdul Jabbar	Harnessing the VQE to Simulate Quantum Chemistry in an Undergraduate Project: Properties of Hydrogen, Oxygen and Water Molecules.	QCE	2023	DBLP DOI BibTeX RDF
12	Nick S. Blunt, György Pál Gehér, Alexandra E. Moylett	Compiling a Simple Chemistry Application to Quantum Error Correction Primitives.	QCE	2023	DBLP DOI BibTeX RDF
12	Hiroya Suno, Nobuaki Ohno	Virtual Hydrogen, a virtual reality education tool in physics and chemistry.	KES	2023	DBLP DOI BibTeX RDF
12	Fatma Alkan	Self-directed Learning in Chemistry Laboratory via Simulations.	ICTERI	2023	DBLP DOI BibTeX RDF
12	Margarida Figueiredo, Catarina Rafael, José Neves 0001, Henrique Vicente	Assessing the Impact of Computer Simulations on Physics and Chemistry Learning.	MIS4TEL	2023	DBLP DOI BibTeX RDF
12	Ishita Naik, Dishita Naik, Nitin Naik	Artificial Intelligence (AI) Applications in Chemistry.	UKCI	2023	DBLP DOI BibTeX RDF
12	Ganesh Arkanath, Nishad Gupta, Hasan Kurban, Parichit Sharma, K. R. Madhavan, Elham Khorasani Buxton, Mehmet M. Dalkilic	Novel NBA Fantasy League driven by Engineered Team Chemistry and Scaled Position Statistics.	IEEE Big Data	2023	DBLP DOI BibTeX RDF
12	Min Hyuk Park	Hafnia-based Ferroelectric Memory: Device Physics Strongly Correlated with Materials Chemistry.	ICICDT	2023	DBLP DOI BibTeX RDF
12	Tzu-Chuen Lu, Shi-Yao Lin, Yu-Xuan Zhou, Biswapati Jana	Serious games applied to the study of the "Substance Structure and Atom" units in chemistry.	iCAST	2023	DBLP DOI BibTeX RDF
12	Yujie Qian, Zhening Li, Zhengkai Tu, Connor W. Coley, Regina Barzilay	Predictive Chemistry Augmented with Text Retrieval.	EMNLP	2023	DBLP DOI BibTeX RDF
12	Gal Peretz, Mousa Arraf, Kira Radinsky	What If: Generating Code to Answer Simulation Questions in Chemistry Texts.	SIGIR	2023	DBLP DOI BibTeX RDF
12	Ryan-Rhys Griffiths, Leo Klarner, Henry B. Moss, Aditya Ravuri, Sang Truong, Yuanqi Du, Samuel Stanton, Gary Tom, Bojana Rankovic, Arian Rokkum Jamasb, Aryan Deshwal, Julius Schwartz, Austin Tripp, Gregory Kell, Simon Frieder, Anthony Bourached, Alex Chan, Jacob Moss, Chengzhi Guo, Johannes Peter Dürholt, Saudamini Chaurasia, Ji Won Park, Felix Strieth-Kalthoff, Alpha A. Lee, Bingqing Cheng, Alán Aspuru-Guzik, Philippe Schwaller, Jian Tang	GAUCHE: A Library for Gaussian Processes in Chemistry.	NeurIPS	2023	DBLP BibTeX RDF
12	Mohammadamin Tavakoli, Pierre Baldi, Ann Marie Carlton, Yin Ting T. Chiu, Alexander Shmakov, David Van Vranken	AI for Interpretable Chemistry: Predicting Radical Mechanistic Pathways via Contrastive Learning.	NeurIPS	2023	DBLP BibTeX RDF
12	Taicheng Guo, Kehan Guo, Bozhao Nan, Zhenwen Liang, Zhichun Guo, Nitesh V. Chawla, Olaf Wiest, Xiangliang Zhang 0001	What can Large Language Models do in chemistry? A comprehensive benchmark on eight tasks.	NeurIPS	2023	DBLP BibTeX RDF
12	Zhichao Zheng 0006, Benhua Wang, Ziwen Wang, Yi Chen, Junsheng Zhou, Li Kong	Automated Analysis of Chemistry Experiment Videos: New Challenges for Video Understanding.	ICCSE (1)	2023	DBLP DOI BibTeX RDF
12	Yangjun Wu, Chu Guo, Yi Fan, Pengyu Zhou, Honghui Shang	NNQS-Transformer: an Efficient and Scalable Neural Network Quantum States Approach for Ab initio Quantum Chemistry.	SC	2023	DBLP DOI BibTeX RDF
12	Nurlaila Hayati, Asep Kadarohman, Wahyu Sopandi	Enhancing Integration of Digital Technology in Higher Education: The Impact of Avogadro Software on Conceptual Understanding in Organic Chemistry Courses in Indonesia.	WSSE	2023	DBLP DOI BibTeX RDF
12	Roudhotul Fitria, Antuni Wiyarsi, Dyana Maftuhatu Rosyidah, Muh Fajrin Arifa	Analysis of Students'Argumentation skill towards Socio-scientific Issues in Chemistry Learning.	WSSE	2023	DBLP DOI BibTeX RDF
12	Jochen Ortmeyer, Fabian Fink, Alexander Hoffmann, Sonja Herres-Pawlis	RDM in Chemistry: How to Educate and Train Future Researchers to Manage Their Data.	CoRDI	2023	DBLP DOI BibTeX RDF
12	Tobias Appel, Kevin Kärcher, Hans-Dieter Körner	Investigating Cognitive Load for Tasks with Mathematics and Chemistry Context through Eye Tracking.	ETRA	2023	DBLP DOI BibTeX RDF
12	Sarwan Ali, Prakash Chourasia, Murray Patterson	When Biology has Chemistry: Solubility And Drug Subcategory Prediction using SMILES Strings.	Tiny Papers @ ICLR	2023	DBLP BibTeX RDF
12	Ingrid von Glehn, James S. Spencer, David Pfau	A Self-Attention Ansatz for Ab-initio Quantum Chemistry.	ICLR	2023	DBLP BibTeX RDF
12	Field M. Watts, Amber J. Dood, Ginger V. Shultz	Automated, content-focused feedback for a writing-to-learn assignment in an undergraduate organic chemistry course.	LAK	2023	DBLP DOI BibTeX RDF
12	Angélica Lizeth Sánchez-López, Oziel Rodrigo Camacho-Ornelas, Luis Marcelo Lozano-Sánchez, Maria Fernanda Rivas-Gastelum, Alejandro Parra-Córdova, Yocanxóchitl Perfecto-Avalos	Enhancing Chemistry Laboratory Teaching through Gamification: The IQ-Mobile race.	TALE	2023	DBLP DOI BibTeX RDF
12	Bilal Aslan, Flávio S. Corrêa da Silva, Geoff Nitschke	Multi-Objective Evolution for Automated Chemistry.	SSCI	2023	DBLP DOI BibTeX RDF
12	Marwan Abualrob, Ahmed Ewais, Fisnik Dalipi, Thawra Awaad	Utilizing Augmented Reality to Enhance Twenty-First Century Skills in Chemistry Education.	EDUCON	2023	DBLP DOI BibTeX RDF
12	Jin Shan, Yuyang Wang 0002, Lik-Hang Lee, Xian Wang, Zeming Chen, Boya Dong, Xinyi Luo, Pan Hui 0001	An immersive simulator for improving chemistry learning efficiency.	VRW	2023	DBLP DOI BibTeX RDF
12	Yiyang Gao, Jasmin Wilson, Patricia Ann Mabrouk	How Do Chemistry Faculty and Graduate Students Engage in Decision Making on Issues Related to Ethical and Responsible Conduct of Research Including Authorship?	Sci. Eng. Ethics	2022	DBLP DOI BibTeX RDF
12	Nicholas J. Curtis, Kyle E. Niemeyer, Chih-Jen Sung	Accelerating reactive-flow simulations using vectorized chemistry integration.	Comput. Phys. Commun.	2022	DBLP DOI BibTeX RDF
12	Germán Kruszewski, Tomás Mikolov	Emergence of Self-Reproducing Metabolisms as Recursive Algorithms in an Artificial Chemistry.	Artif. Life	2022	DBLP DOI BibTeX RDF
12	Shuangshuang Wu, Jianping Chen, Li Li, Cheng Zhang, Rujin Huang, Quanping Zhang	Quantitative Inversion of Lunar Surface Chemistry Based on Hyperspectral Feature Bands and Extremely Randomized Trees Algorithm.	Remote. Sens.	2022	DBLP DOI BibTeX RDF
12	Aloys Iyamuremye, Ezechiel Nsabayezu, Janvier Mukiza	Web-Based Discussion in Teaching and Learning Organic Chemistry: Student's Conception and Reflection.	Int. J. Emerg. Technol. Learn.	2022	DBLP DOI BibTeX RDF
12	Kusumawati Dwiningsih, Fauziatul Fajaroh, Parlan Parlan, Munzil Munzil, Habiddin Habiddin	3D Molecular Interactive Multimedia for Building Chemistry Students' Spatial Ability.	Int. J. Emerg. Technol. Learn.	2022	DBLP DOI BibTeX RDF
12	Shaykhah S. Aldosari, Bogdan Ghita 0003, Davide Marocco	A Gesture-Based Educational System that Integrates Simulation and Molecular Visualization to Teach Chemistry.	Int. J. Emerg. Technol. Learn.	2022	DBLP DOI BibTeX RDF
12	Nana Yaw Asabere, Gerald Elorm Gbagbe, Eyram Akofa Tawia, Joshua Etse Amegashie, Daniel Awuley Ayin	Pedagogically-Improved Blended Learning of a Chemistry Course Through a Computerized Virtual Laboratory.	Int. J. Online Pedagog. Course Des.	2022	DBLP DOI BibTeX RDF
12	Dewi Handayani, Endang Widi Winarni, Agus Sundaryono, M. Lutfi Firdaus, Muzanip Alperi	Development of Organic Chemistry Teaching Materials on The Topic of Lipid Using Android STEM Based Approach.	Int. J. Interact. Mob. Technol.	2022	DBLP DOI BibTeX RDF
12	Muhammad Nazar, Rusman, Kana Puspita, Husnul Yaqin	Android-Based Mobile Learning Resource for Chemistry Students in Comprehending the Concept of Redox Reactions.	Int. J. Interact. Mob. Technol.	2022	DBLP DOI BibTeX RDF
12	Marianne Noel	Opening Up of Editorial Activities at Chemistry Journals. What Does Editorship Mean and What Does It Involve?	Frontiers Res. Metrics Anal.	2022	DBLP DOI BibTeX RDF
12	Min Wang, Zhihan Lv	Construction of personalized learning and knowledge system of chemistry specialty via the internet of things and clustering algorithm.	J. Supercomput.	2022	DBLP DOI BibTeX RDF
12	Kai Trepte, Johannes Voss	Data-driven and constrained optimization of semi-local exchange and nonlocal correlation functionals for materials and surface chemistry.	J. Comput. Chem.	2022	DBLP DOI BibTeX RDF
12	Wernhuar Tarng, Yu-Cheng Tseng, Kuo-Liang Ou	Application of Augmented Reality for Learning Material Structures and Chemical Equilibrium in High School Chemistry.	Syst.	2022	DBLP DOI BibTeX RDF
12	Modjtaba Ghorbani, Mardjan Hakimi-Nezhaad, Matthias Dehmer	Novel results on partial hosoya polynomials: An application in chemistry.	Appl. Math. Comput.	2022	DBLP DOI BibTeX RDF
12	Ewa D. Raczynska	Symmetry in Acid-Base Chemistry.	Symmetry	2022	DBLP DOI BibTeX RDF
12	Carina Lee, Jessica M. Weber, Laura E. Rodriguez, Rachel Y. Sheppard, Laura M. Barge, Eve L. Berger, Aaron S. Burton	Chirality in Organic and Mineral Systems: A Review of Reactivity and Alteration Processes Relevant to Prebiotic Chemistry and Life Detection Missions.	Symmetry	2022	DBLP DOI BibTeX RDF
12	Paulo A. F. Rezeck, Luiz Chaimowicz	Chemistry-Inspired Pattern Formation With Robotic Swarms.	IEEE Robotics Autom. Lett.	2022	DBLP DOI BibTeX RDF
12	Masato Sumita, Kei Terayama, Ryo Tamura, Koji Tsuda	QCforever: A Quantum Chemistry Wrapper for Everyone to Use in Black-Box Optimization.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Yuliana Zabolotna, Dmitriy M. Volochnyuk, Sergey V. Ryabukhin, Dragos Horvath, Konstantin S. Gavrilenko, Gilles Marcou, Yurii S. Moroz, Oleksandr Oksiuta, Alexandre Varnek	A Close-up Look at the Chemical Space of Commercially Available Building Blocks for Medicinal Chemistry.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Maciej Spiegel	Current Trends in Computational Quantum Chemistry Studies on Antioxidant Radical Scavenging Activity.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Andrea Jacobs, Dustin Williams, Katherine Hickey, Nathan Patrick, Antony J. Williams, Stuart J. Chalk, Leah McEwen, Egon L. Willighagen, Martin Walker, Evan Bolton, Gabriel Sinclair, Adam Sanford	CAS Common Chemistry in 2021: Expanding Access to Trusted Chemical Information for the Scientific Community.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Giulia Palermo	Celebrating Women of Color in Computational Chemistry.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Neetu Tripathi, Manoj Kumar Goshisht	Advancing Women in Chemistry: A Step Toward Gender Parity.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Guo-Wei Wei 0001, Thereza A. Soares, Habibah A. Wahab, Feng Zhu 0004	Computational Chemistry in Asia.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Zoe Cournia, Thereza A. Soares, Habibah A. Wahab, Rommie E. Amaro	Celebrating Diversity, Equity, Inclusion, and Respect in Computational and Theoretical Chemistry.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Giulia Palermo	Celebrating the Next Generation of Women in Computational Chemistry to Increase Diversity, Equity, Inclusion, and Respect.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Raphaël Robidas, Claude Y. Legault	CalcUS: An Open-Source Quantum Chemistry Web Platform.	J. Chem. Inf. Model.	2022	DBLP DOI BibTeX RDF
12	Kaitlin McCardle, Jie Pan 0002	Computational chemistry for all.	Nat. Comput. Sci.	2022	DBLP DOI BibTeX RDF
12	Kamisah Osman, Ah Nam Lay	MyKimDG module: an interactive platform towards development of twenty-first century skills and improvement of students' knowledge in chemistry.	Interact. Learn. Environ.	2022	DBLP DOI BibTeX RDF
12	Senol Sen	Modelling the relations between Turkish chemistry teachers' sense of efficacy and technological pedagogical content knowledge in context.	Interact. Learn. Environ.	2022	DBLP DOI BibTeX RDF
12	Riccardo Malpica Galassi, Pietro Paolo Ciottoli, Mauro Valorani, Hong G. Im	An adaptive time-integration scheme for stiff chemistry based on computational singular perturbation and artificial neural networks.	J. Comput. Phys.	2022	DBLP DOI BibTeX RDF
12	Renan Amorim da Silva, Flávia Cristina Gomes Catunda de Vasconcelos	Learning through chemistry simulations: an analysis of cognitive skill levels.	Educ. Inf. Technol.	2022	DBLP DOI BibTeX RDF
12	Numan Ali, Sehat Ullah, Dawar Khan	Minimization of students' cognitive load in a virtual chemistry laboratory via contents optimization and arrow-textual aids.	Educ. Inf. Technol.	2022	DBLP DOI BibTeX RDF
12	Ezechiel Nsabayezu, Aloys Iyamuremye, Valentine Urengejeho, Janvier Mukiza, Fidele Ukobizaba, Agnes Mbonyiryivuze, Jean de Dieu Kwitonda	Computer-based learning to enhance chemistry instruction in the inclusive classroom: Teachers' and students' perceptions.	Educ. Inf. Technol.	2022	DBLP DOI BibTeX RDF
12	Ezechiel Nsabayezu, Janvier Mukiza, Aloys Iyamuremye, Odile Umuhire Mukamanzi, Agnes Mbonyiryivuze	Rubric-based formative assessment to support students' learning of organic chemistry in the selected secondary schools in Rwanda: A technology-based learning.	Educ. Inf. Technol.	2022	DBLP DOI BibTeX RDF
12	Aloys Iyamuremye, Janvier Mukiza, Ezechiel Nsabayezu, Fidele Ukobizaba, Kizito Ndihokubwayo	Web-based discussions in teaching and learning: Secondary school teachers' and students' perception and potentiality to enhance students' performance in organic chemistry.	Educ. Inf. Technol.	2022	DBLP DOI BibTeX RDF
12	Natinan Bunyakul, Nuwee Wiwatwattana, Patcharin Panjaburee	Effects of a mobile game on students' learning achievements and motivations in a clinical chemistry course: learning style differences.	Int. J. Mob. Learn. Organisation	2022	DBLP DOI BibTeX RDF
12	Saad Yalouz, Martin Rafael Gullin, Sajanthan Sekaran	QuantNBody: a Python package for quantum chemistry and physics to build and manipulate many-body operators and wave functions.	J. Open Source Softw.	2022	DBLP DOI BibTeX RDF
12	Piotr Bartman, Oleksii Bulenok, Kamil Górski, Anna Jaruga, Grzegorz Lazarski, Michael A. Olesik, Bartosz Piasecki, Clare E. Singer, Aleksandra Talar, Sylwester Arabas	PySDM v1: particle-based cloud modeling package for warm-rain microphysics and aqueous chemistry.	J. Open Source Softw.	2022	DBLP DOI BibTeX RDF
12	Lutz Bornmann, Robin Haunschild	Empirical analysis of recent temporal dynamics of research fields: Annual publications in chemistry and related areas as an example.	J. Informetrics	2022	DBLP DOI BibTeX RDF
12	William J. Godinez, Eric J. Ma, Alexander T. Chao, Luying Pei, Peter Skewes-Cox, Stephen M. Canham, Jeremy L. Jenkins, Joseph M. Young, Eric J. Martin, Armand Guiguemde	Design of potent antimalarials with generative chemistry.	Nat. Mach. Intell.	2022	DBLP DOI BibTeX RDF
12	Thomas D. Barrett, Aleksei O. Malyshev, A. I. Lvovsky 0001	Autoregressive neural-network wavefunctions for ab initio quantum chemistry.	Nat. Mach. Intell.	2022	DBLP DOI BibTeX RDF
12	B. Braida, J. Dalphin, Charles Dapogny, P. Frey, Yannick Privat	Shape and topology optimization for maximum probability domains in quantum chemistry.	Numerische Mathematik	2022	DBLP DOI BibTeX RDF
12	Ying Zhan, Austin Fergusson, Lacey R. McNally, Richey M. Davis, Bahareh Behkam	Robust and Repeatable Biofabrication of Bacteria-Mediated Drug Delivery Systems: Effect of Conjugation Chemistry, Assembly Process Parameters, and Nanoparticle Size.	Adv. Intell. Syst.	2022	DBLP DOI BibTeX RDF
12	Li Lin, Dayun Yan, Taeyoung Lee, Michael Keidar	Self-Adaptive Plasma Chemistry and Intelligent Plasma Medicine.	Adv. Intell. Syst.	2022	DBLP DOI BibTeX RDF
12	Yael Feldman-Maggor, Ron Blonder, Inbal Tuvi-Arad	Let them choose: Optional assignments and online learning patterns as predictors of success in online general chemistry courses.	Internet High. Educ.	2022	DBLP DOI BibTeX RDF
12	Harry Ramanantoanina	LFDFT - A Practical Tool for Coordination Chemistry.	Comput.	2022	DBLP DOI BibTeX RDF
12	Sumeet Batra, John Klingner, Nikolaus Correll	Augmented reality for human-swarm interaction in a swarm-robotic chemistry simulation.	Artif. Life Robotics	2022	DBLP DOI BibTeX RDF
12	Tianchen Zhao, James Stokes, Shravan K. Veerapaneni	Scalable neural quantum states architecture for quantum chemistry.	CoRR	2022	DBLP DOI BibTeX RDF
12	Lorenzo Branca, Andrea Pallottini	Neural networks: solving the chemistry of the interstellar medium.	CoRR	2022	DBLP DOI BibTeX RDF
12	Ezzeddine El Sai, Parker Gara, Markus J. Pflaum	Algebraic Machine Learning with an Application to Chemistry.	CoRR	2022	DBLP DOI BibTeX RDF
12	Mathis Bode	Applying Physics-Informed Enhanced Super-Resolution Generative Adversarial Networks to Finite-Rate-Chemistry Flows and Predicting Lean Premixed Gas Turbine Combustors.	CoRR	2022	DBLP DOI BibTeX RDF
12	Siwar Badreddine, Igor Chollet, Laura Grigori	Factorized structure of the long-range two-electron integrals tensor and its application in quantum chemistry.	CoRR	2022	DBLP DOI BibTeX RDF
12	Naruki Yoshikawa, Andrew Zou Li, Kourosh Darvish, Yuchi Zhao, Haoping Xu, Alán Aspuru-Guzik, Animesh Garg, Florian Shkurti	An Adaptive Robotics Framework for Chemistry Lab Automation.	CoRR	2022	DBLP DOI BibTeX RDF
12	Jay Paul Morgan, Adeline Paiement, Christian Klinke	Domain-informed graph neural networks: a quantum chemistry case study.	CoRR	2022	DBLP DOI BibTeX RDF
12	Amol Salunkhe, Dwyer Deighan, Paul E. DesJardin, Varun Chandola	Physics Informed Machine Learning for Chemistry Tabulation.	CoRR	2022	DBLP DOI BibTeX RDF
12	Ryan-Rhys Griffiths, Leo Klarner, Henry B. Moss, Aditya Ravuri, Sang Truong, Bojana Rankovic, Yuanqi Du, Arian R. Jamasb, Julius Schwartz, Austin Tripp, Gregory Kell, Anthony Bourached, Alex Chan, Jacob Moss, Chengzhi Guo, Alpha A. Lee, Philippe Schwaller, Jian Tang	GAUCHE: A Library for Gaussian Processes in Chemistry.	CoRR	2022	DBLP DOI BibTeX RDF
12	Patrick Reiser, Marlen Neubert, André Eberhard, Luca Torresi, Chen Zhou, Chen Shao, Houssam Metni, Clint van Hoesel, Henrik Schopmans, Timo Sommer, Pascal Friederich	Graph neural networks for materials science and chemistry.	CoRR	2022	DBLP DOI BibTeX RDF
12	Gangmin Son, Jinhyuk Yun, Hawoong Jeong	Quantifying team chemistry in scientific collaboration.	CoRR	2022	DBLP BibTeX RDF
12	Hatem Fakhruldeen, Gabriella Pizzuto, Jakub Glowacki, Andrew Ian Cooper	ARChemist: Autonomous Robotic Chemistry System Architecture.	CoRR	2022	DBLP DOI BibTeX RDF
12	Ahmad Peyvan, Khemraj Shukla, Jesse Chan, George Em Karniadakis	High-Order Methods for Hypersonic Flows with Strong Shocks and Real Chemistry.	CoRR	2022	DBLP DOI BibTeX RDF