Cover Image

GEOM-QM9 & GEOM-DRUGS preprocessed conformer pickles (Align Your Structures, ICLR 2026)

Fuente: Zenodo

Saved in:

Bibliographic Details
Main Authors:	Iyengar, Aniketh, Han, Jiaqi, Sun, Pengwei, Jiang, Mingjian, Xie, Jianwen, Ermon, Stefano
Format:	Recurso digital
Language:	English
Published:	Zenodo 2026
Subjects:	molecular conformers GEOM-QM9 GEOM-DRUGS diffusion models generative models ICLR 2026
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

TriAnchor-ID: Multi-View Semantic Identity Anchoring for Pose-Aware Personalized Diffusion
by: KUMAR, AKASH
Published: (2026)

TriAnchor-ID: Multi-View Semantic Identity Anchoring for Pose-Aware Personalized Diffusion
by: KUMAR, AKASH
Published: (2026)

The Solid-State and Solution-State Reassigned Structures of Tagitinin A, a 3,10-Epoxy-Germacrolide from Tithonia diversifolia, and the Interconversion of 3,10-Epoxy-Germacrolide Conformational Families via a Ring-Atom Flip Mechanism
by: Robert Glaser
Published: (2005)

The correlation between electronic structure and antitumor activity of a selective focal adhesion kinase inhibitors
by: Daniel Augusto Barra de Oliveira
Published: (2018)

Ep. 869: Why Tiny Digital Savants Are Outperforming God-Models
by: Rosehill, Daniel, et al.
Published: (2026)

Eternal Universe Theory – Mirror Edition E(u₁) = –E(u₂) Final Unified Framework: LGO-IFF, ER=EPR, RH Resolution Eternal, Singularity-Free Cosmology with Prime-Tuned Geometry
by: Frank, Karol, et al.
Published: (2025)

DNA-Diffusion
by: Bejan, Matei, et al.
Published: (2025)

DRYING KINETICS OF TWO YAM (Dioscorea alata) VARIETIES
by: RAMIRO TORRES
Published: (2012)

Structures in pdb format for the paper "How structural dynamics influence the substrate oxidation energetics in lytic polysaccharide monooxygenases"
by: Hedegård, Erik
Published: (2025)

Iran 2026: The Fall of the Khamenei Dynasty
by: Rosehill, Daniel, et al.
Published: (2026)

Identity, Rigidity, and Collapse: A UPC–QM Model of Why Some Minds Can't Update Their Maps
by: Escagedo Gutierrez, Eloy
Published: (2026)

Kinetic aspects of a dried thin layer carrot in a heat pump dryer
by: Juan Carlos Gómez-Daza
Published: (2016)

The M&A Renaissance: AI, Big Deals, and Banking Silos
by: Rosehill, Daniel, et al.
Published: (2026)

Cross-Generator Generalization of CNN-Based AI Face Detectors: A Grad-CAM Region-Consistency Analysis
by: Gargouri, Ismail, et al.
Published: (2026)

Analytical solution of the time fractional diffusion equation and fractional convection-diffusion equation
by: V. F. Morales-Delgado
Published: (2019)

A supramolecular proposal of lignin structure and its relation with the wood properties
by: HEBER S. ABREU
Published: (2009)

Osmotic dehydration of sweet potato (Ipomoea batatas) in ternary solutions
by: Graziella Colato ANTONIO
Published: (2008)

Modeling of transient mass transfer of a gaseous component in an isothermal porous adsorbent
by: Anélie Pétrissans
Published: (2010)

Sorption isotherms for oat flakes (Avena sativa L.)
by: José Edgar Zapata M.
Published: (2014)

Drying and color in punamuña leaves (Satureja boliviana)
by: David Choque-Quispe
Published: (2021)

User study of sensorless adaptive haptic assistance for bilateral teleoperation
by: Tobias Ring
Published: (2023)

PARAMETER STABILITY IN FREIGHT GENERATION AND DISTRIBUTION DEMAND MODELS IN COLOMBIA
by: JOSE HOLGUÍN-VERAS
Published: (2011)

Investigación sobre la inhibición del virus del Zika mediante métodos computacionales de dinámica molecular e híbridos (QM/MM)
by: Gabriel Martínez Gutiérrez
Published: (2025)

Investigation of the effect of temperature and pretreatment on the rehydration capacities of dried nectarine slices
by: Fatma Soysal
Published: (2017)

Evaluation of semi-empirical and non-linear drying models by Bayesian inference
by: Ricardo Cardoso de Oliveira
Published: (2014)

Molecular and multiscale modeling: Review on the theories and applications in chemical engineering
by: Giovanni Morales Medina
Published: (2009)

Mathematical model for a mixed energy system as a technological alternative in the supply of electrical energy in non-interconnected areas
by: Oscar Iván Galvis Cabrera
Published: (2017)

Molecular Speciation Effect on Docking and Drug Design. A Computational Study for Mangiferin, a Carbohydrate-Polyphenol Bioconjugate as a Test Case
by: Berenice Gómez Zaleta
Published: (2008)

Global dynamics for a class of reaction–diffusion multigroup SIR epidemic models with time fractional-order derivatives*
by: Zhenzhen Lu
Published: (2022)

Reaction kinetic parameters for a distributed model of transport and reaction in Pd/Rh/CeZrO three-way catalytic converters
by: Camilo Rosero-Chicaíza
Published: (2019)

INFLUENCE OF THICKNESS ON THE DRYING OF PAPAYA PUREE (Carica papaya L.) THROUGH REFRACTANCE WINDOWTM TECHNOLOGY
by: MARÍA U. OCORÓ-ZAMORA
Published: (2013)

Parabolic Systems Involving Sectorial Operators: Existence andUniqueness of Global Solutions
by: Miguel Yangari
Published: (2016)

Ep. 901: The Iranian Decapitation: Four Paths After the Strike
by: Rosehill, Daniel, et al.
Published: (2026)

Ep. 881: Israel SITREP; 27 Feb 23:20 (21:20 UTC)
by: Rosehill, Daniel, et al.
Published: (2026)

Second virial coefficient of a series of polysiloxanes: the effect of side groups and molecular weight
by: J. A. Villegas
Published: (2006)

The Transformer Trinity: Why Three Architectures Rule AI
by: Rosehill, Daniel, et al.
Published: (2026)

European Journal of Translational Myology
Published: (2013)

Conformal Elastodynamics in 2D Dilational Metamaterials
by: Singh, Neel, et al.
Published: (2026)

Algorithms to Generate Random Samples following the Swerling Models
by: Camilo Guillén Soriano
Published: (2019)

Spiral Economic Dynamics (SED): Market Cycles and Innovation Patterns Through Spiral Modeling
by: Garbar, Iryna
Published: (2025)