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M58TL5
[ { "role": "user", "content": "MAVSVTPIRDTKWLTLEVCREFQRGTCSRPDTECKFAHPSKSCQVENGRVIACFDSLKGRCSRENCKYLHPPPHLKTQLEINGRNNLIQQKNMAMLAQQMQLANAMMPGAPLQPVPMFSVAPSLATNASAAAFNPYLGPVSPSLVPAEILPTAPMLVTGNPGVPVPAAAAAAAQKLMRTDRLEVCREYQRGNCNRGENDCRFAHPADSTMIDTNDNTVTVCMDYIKGRCSREKCKYFHPPAHLQAKIKAAQYQVNQAAAAQAAATAAAMTQSAVKSLK...
[]
[]
{ "subject": "Biology", "task_type": "Protein sequence function analysis", "language": "en", "turns": 1, "label": null }
WDSS7E
[ { "role": "user", "content": "Do we know whether this drug is applied topically? N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1.O=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.O=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO" }, { "role": "assistant", "content": "<think>\nWe need to analyze the giv...
[]
[]
{ "subject": "Chemistry", "task_type": "Molecular usage and drug role description", "language": "en", "turns": 1, "label": null }
WKORC2
[ { "role": "user", "content": "A clean vector scientific schematic diagram of a supernet architecture for few-shot adaptation. The layout features a large light gray container holding three vertical blocks labeled $g_1^{\\phi, \\phi', \\alpha}$, $g_2^{\\phi, \\phi', \\alpha}$, and $g_K^{\\phi, \\phi', \\alph...
[]
[]
{ "subject": "CS", "task_type": "Image editing", "language": "en", "turns": 3, "label": { "type": "image_edit", "value": [ "assets/sci_multi/dev_images_2306.09295_2306.09295_supernet-arch.png_turn1.png", "assets/sci_multi/dev_images_2306.09295_2306.09295_supernet-arch.png_turn2.png", ...
LNGBZ4
[ { "role": "user", "content": "Protein-site prediction problem:\n Predict the key contact residues in <PROT>ISGDSVSSNSAAWRTYYRSKWFNDARGIVFSYAMDVWGSCTRSSGSIASYYVQWYIYEDSQRPSGVYCQSYDSSNVVFG</PROT> that drive antibody recognition of antigens." }, { "role": "assistant", "content": "<think>\nTh...
[]
[]
{ "subject": "Biology", "task_type": "Protein antibody binding site prediction", "language": "en", "turns": 1, "label": { "type": "prot_cla", "value": [ 14, 16, 18, 19, 20, 22, 24, 29, 30, 32, 48, 49, 50, 51, 58,...
144TZI
[ { "role": "user", "content": "Protein-site prediction problem:\n Locate potential RNA-interaction hotspots on protein sequence <PROT>HVFKSRLQEYAQKYKLPTPVYEIVKEGPSHKSLFQSTVILDGVRYNSLPGFFNRKAAEQSAAEVALRELAK</PROT>." }, { "role": "assistant", "content": "<think>\nThe user wants to identify p...
[]
[]
{ "subject": "Biology", "task_type": "Protein RNA binding site prediction", "language": "en", "turns": 1, "label": { "type": "prot_cla", "value": [ 29, 30, 34, 52, 53, 54 ] } }
BLMMDP
[ { "role": "user", "content": "MELLCHEVDPVRRAVRDRNLLRDDRVLQNLLTIEERYLPQCSYFKCVQKDIQPYMRRMVATWMLEVCEEQKCEEEVFPLAMNYLDRFLAGVPTPKSHLQLLGAVCMFLASKLKETSPLTAEKLCIYTDNSIKPQELLEWELVVLGKLKWNLAAVTPHDFIEHILRKLPQQREKLSLIRKHAQTFIALCATGGRISGSHQHLTSPDFKFAMYPPSMIATGSVGAAICGLQQDEEVSSLTCDALTELLAKITNTDVDCLKACQEQIEAVLLNSLQQYRQD...
[]
[]
{ "subject": "Biology", "task_type": "Protein PPI binding site prediction", "language": "en", "turns": 1, "label": null }
OFJA5N
[ { "role": "user", "content": "Can you tell me what the HOMO energy is for the molecule with this SMILES? O=C1OC2C3OC1C23O" }, { "role": "assistant", "content": "<think>\nWe need to determine the HOMO energy for the molecule with the SMILES string \"O=C1OC2C3OC1C23O\". This is a request for a spe...
[]
[]
{ "subject": "Chemistry", "task_type": "Molecular HOMO energy prediction", "language": "en", "turns": 1, "label": null }
YA4VGH
[ { "role": "user", "content": "<image>Generate a sharp, high-resolution brain MRI from this 4x K-space truncated low-resolution T1 input." }, { "role": "assistant", "content": "<think>\nExamining the provided scan, I recognize the distinct intensity patterns of a T1-weighted sequence even though ...
[ "assets/sci_edit/LRx4_IXI567_HH_2536_T1_slice_069.png" ]
[]
{ "subject": "Medicine", "task_type": "Brain MRI image super-resolution", "language": "en", "turns": 1, "label": { "type": "image_edit", "value": [ "assets/sci_edit/HR_IXI567_HH_2536_T1_slice_069.png" ] } }
QV2JOI
[ { "role": "user", "content": "<SMILES>C1CCCC1</SMILES> 在 298.15 K 下的定容热容 Cv 预计是多少?请以 cal/(mol*K) 表示。" }, { "role": "assistant", "content": "<think>\n首先,输入的 SMILES 字符串 C1CCCC1 对应的是一个由五个碳原子构成的饱和脂环烃,即环戊烷。该分子完全由碳和氢两种轻元素组成,不含任何杂原子、双键或芳香环系,属于典型的非极性饱和碳氢化合物。从三维空间构型来看,五元环并非完美的平面结构,而是通过采取信封式等折叠构象来缓解角张力与扭转...
[]
[]
{ "subject": "Chemistry", "task_type": "Molecular isochoric heat capacity prediction", "language": "zh", "turns": 1, "label": { "type": "linear_pre", "value": 18.624 } }
SYETTZ
[ { "role": "user", "content": "请预测 <SMILES>CCCCOC(=O)c1ccccc1Nc1cccc(C(F)(F)F)c1</SMILES> 的转换后急性毒性 LD50 数值(单位/尺度:-log10(mol/kg));该转换值越高通常表示急性毒性越强。" }, { "role": "assistant", "content": "<think>\n首先,从分子骨架来看,该 SMILES 对应一个具有二芳胺核心结构的化合物。其结构主要由一个丁氧羰基取代的苯环通过仲氨基与一个间三氟甲基取代的苯环相连构成。分子中包含了正丁氧基、两个芳香环以及一个三氟甲基...
[]
[]
{ "subject": "Chemistry", "task_type": "Molecular LD50 acute toxicity prediction", "language": "zh", "turns": 1, "label": { "type": "linear_pre", "value": 2.8200000000000003 } }
2P3YVB
[ { "role": "user", "content": "What makes the Fe3C(Fe)@NDGL catalyst more effective?" }, { "role": "assistant", "content": "<think>\nThe catalyst notation Fe3C(Fe)@NDGL suggests a composite where Fe3C (iron carbide) and possibly metallic Fe species are supported on or encapsulated by nitrogen-dop...
[]
[]
{ "subject": "Materials", "task_type": "Materials science benchmark QA", "language": "en", "turns": 1, "label": null }
11GQ9Z
[ { "role": "user", "content": "蛋白质位点预测问题:\n 对于 <PROT>ASGFTFSSYGMVIWYDGTNTYARDLAYRDYVWRYFDLWGSCRASQSVSTYLAWYIYDASNRATGIYCQCRSNWPGITFG</PROT>,找出可能位于抗原结合区域的残基。" }, { "role": "assistant", "content": "<think>\n基于序列特征分析,该 83 个残基的多肽对应于免疫球蛋白重链可变区(VH)或单域抗体(VHH/Nanobody)的可变结构域。抗原结合位点(paratope)主要位于三个...
[]
[]
{ "subject": "Biology", "task_type": "Protein antibody binding site prediction", "language": "zh", "turns": 1, "label": { "type": "prot_cla", "value": [ 14, 16, 18, 19, 21, 27, 28, 29, 30, 31, 33, 48, 49, 50, 70,...
V77G1P
[ { "role": "user", "content": "MSHTILLVQPTKRPEGRTYADYESVNECMEGVCKMYEEHLKRMNPNSPSITYDISQLFDFIDDLADLSCLV\nIs the protein involved in mRNA processing?" }, { "role": "assistant", "content": "<think>\nWe need to analyze the protein sequence: MSHTILLVQPTKRPEGRTYADYESVNECMEGVCKMYEEHLKRMNPNSPSITYDISQLFDF...
[]
[]
{ "subject": "Biology", "task_type": "Protein function description", "language": "en", "turns": 1, "label": null }
JGVKSY
[ { "role": "user", "content": "<image>使用半透明的黄色来标示这张页岩 SEM 图像中的固体岩石相。" }, { "role": "assistant", "content": "<think>\n扫描这张 SEM 图像揭示了一种经典的页岩微观结构,其主要特征是紧密堆积的粘土矿物集合体。我注意到岩石基质由这些细颗粒组成,它们包围着中心区域可见的那个显著的不规则孔隙。这种结构表明孔隙度主要是粒间孔隙,源于伊利石或混合层粘土簇的排列。为了满足要求,我需要准确地将这些固体矿物相与空隙空间分割开来。我准备好定义粘土基质的边界,并生成黄色半透明覆盖层以强调固体框...
[ "assets/sci_edit/imgs_F1-1HF-ID-179_006-Mag-6000x-Scale-20um-Depth-3668.2m_resizeTo_20.0KX_up_left_21.png" ]
[]
{ "subject": "Geography", "task_type": "Rock SEM image segmentation", "language": "zh", "turns": 1, "label": { "type": "image_edit", "value": [ "assets/sci_edit/labels_yellow_F1-1HF-ID-179_006-Mag-6000x-Scale-20um-Depth-3668.2m_resizeTo_20.0KX_up_left_21.png" ] } }
2T1TDG
[ { "role": "user", "content": "MASRSKRRAVESGVPQPPDPPVQRDEEEEKEVENEDEDDDDSDKEKDEEDEVIDEEVNIEFEAYSLSDNDYDGIKKLLQQLFLKAPVNTAELTDLLIQQNHIGSVIKQTDVSEDSNDDMDEDEVFGFISLLNLTERKGTQCVEQIQELVLRFCEKNCEKSMVEQLDKFLNDTTKPVGLLLSERFINVPPQIALPMYQQLQKELAGAHRTNKPCGKCYFYLLISKTFVEAGKNNSKKKPSNKKKAALMFANAEEEFFYEGKPEVLGGPDTRRGLEPVPI...
[]
[]
{ "subject": "Biology", "task_type": "Protein function prediction", "language": "en", "turns": 1, "label": null }
C3Y7HA
[ { "role": "user", "content": "How does the mechanical behavior of soft tissue contribute to injuries sustained during physical activities or accidents?" }, { "role": "assistant", "content": "<think>\nHmm, the user is asking a biomechanics question about how soft tissue's mechanical behavior lead...
[]
[]
{ "subject": "Biology", "task_type": "Graduate-level open-ended biology QA", "language": "en", "turns": 1, "label": null }
8S2XEM
[ { "role": "user", "content": "Given the description in The molecule is a natural product found in Streptomyces xiamenensis with data available., construct the molecule." }, { "role": "assistant", "content": "<think>\nThe description points to a natural product isolated from the marine-derived ac...
[]
[]
{ "subject": "Chemistry", "task_type": "Chemical entity recognition", "language": "en", "turns": 1, "label": null }
Z2UESW
[ { "role": "user", "content": "<file>\n<image>\nPlease analyze the infrared spectrum given above and predict the functional groups that may be present." }, { "role": "assistant", "content": "<think>\nBased on the provided IR spectrum, I will perform a systematic analysis starting from the high-wa...
[ "assets/spectra_images/045806_ir.png" ]
[ "assets/spectra_jdx/045806_ir.jdx" ]
{ "subject": "Chemistry", "task_type": "IR spectrum functional group identification", "language": "en", "turns": 1, "label": null }
41GJM7
[ { "role": "user", "content": "Protein-site prediction problem:\n Determine which residues of antigen <PROT>DFGLDCDEESRCCRYPLTVDFEAFGWDWIIAPKRYKANYCSGECEFVFLQKYPHTHLVHQANPRGSAGPCCTPTKMSPINMLYFNGKEQIIYGKIPAMVVDRCGCS</PROT> may function as epitope residues." }, { "role": "assistant", "conten...
[]
[]
{ "subject": "Biology", "task_type": "Protein epitope prediction", "language": "en", "turns": 1, "label": { "type": "prot_cla", "value": [ 22, 27, 28, 30, 31, 32, 33, 80, 82, 84, 88, 89, 90, 91, 92 ] } }
T93K2H
[ { "role": "user", "content": "MQDVVIVAATRTAVGSFQGSLAGIPAPELGAAVIRRLLEQTGLDAGQVDEVILGQVLTAGSGQNPARQAAIKAGLPVGVPAMTLNKVCGSGLKALHLGAQAIRCGDAEVIVAGGQENMSLAPYVMPGARTGLRMGHAKLVDSMIEDGLWDAFNDYHMGITAENLAEKYGLTREEQDAFAAASQQKAIAAIEGGRFRDEITPIQVPQRKGEPLGFDTDEQPRAGTTVEALAKLKPAFRKDGSVTAGNASSLNDGAAAVLLMSAAKAKALGLPVLARIAS...
[]
[]
{ "subject": "Biology", "task_type": "Protein standard name", "language": "en", "turns": 1, "label": null }
ZFZZ8O
[ { "role": "user", "content": "<image>Use a yellow semi-transparent color to indicate the solid grain areas in this sandstone SEM image." }, { "role": "assistant", "content": "<think>\nLooking at this scanning electron micrograph, I can immediately distinguish the coarse mineral framework typical...
[ "assets/sci_edit/imgs_plug_44_image_13-0_0.17um_top_right_up_left_63.png" ]
[]
{ "subject": "Geography", "task_type": "Rock SEM image segmentation", "language": "en", "turns": 1, "label": { "type": "image_edit", "value": [ "assets/sci_edit/labels_yellow_plug_44_image_13-0_0.17um_top_right_up_left_63.png" ] } }
7T7G4O
[ { "role": "user", "content": "蛋白质位点预测问题:\n确定蛋白质 <PROT>GTSLTDEELVTSVRELNQHLRGLSKEEIIQLKQRRRTLKNRGYAASCRVKRVTQKEELEKQKAELQQEVEKLASENASKLELDALRSKYE</PROT> 中的哪些残基可能形成 DNA 结合界面。" }, { "role": "assistant", "content": "<think>\n让我分析这个蛋白质序列以预测 DNA 结合残基。蛋白质序列为:\nGTSLTDEELVTSVRELNQHLRGLSKEEIIQLKQRRRTLKNRG...
[]
[]
{ "subject": "Biology", "task_type": "Protein DNA binding site prediction", "language": "zh", "turns": 1, "label": { "type": "prot_cla", "value": [ 35, 36, 39, 40, 41, 43, 44, 47, 48, 50, 51 ] } }
NCVMA1
[ { "role": "user", "content": "<file>\n<image>\nPlease analyze the infrared spectrum given above and predict the functional groups that may be present." }, { "role": "assistant", "content": "<think>\nObserving the high wavenumber region between 4000 and 3000 cm⁻¹, I note two distinct, relatively ...
[ "assets/spectra_images/029057_ir.png" ]
[ "assets/spectra_jdx/029057_ir.jdx" ]
{ "subject": "Chemistry", "task_type": "IR spectrum functional group identification", "language": "en", "turns": 1, "label": null }
H81ETI
[ { "role": "user", "content": "基于 Ames 试验,<SMILES>CN(Cc1ccccc1)C(=O)CBr</SMILES> 是否会被认为具有遗传毒性?Ames 阳性通常提示化合物可能诱导基因突变。" }, { "role": "assistant", "content": "<think>\n首先,对目标分子的结构特征进行解析。该分子的 SMILES 为 CN(Cc1ccccc1)C(=O)CBr,其核心骨架为一个 N-甲基-N-苄基-2-溴乙酰胺结构。分子中包含一个单取代苯环作为疏水芳香片段,通过亚甲基与叔酰胺氮原子相连。酰胺羰基的 α 位连接有一...
[]
[]
{ "subject": "Chemistry", "task_type": "Molecular Ames mutagenicity classification", "language": "zh", "turns": 1, "label": { "type": "linear_cla", "value": 0 } }
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S1-Omni-Corpus-10K

An open-source scientific multimodal reasoning dataset subset for S1-Omni

arXiv Dataset Hugging Face ModelScope License

🧬 Model Introduction

S1-Omni is a unified scientific multimodal reasoning model for scientific understanding, prediction, and generation. It is developed by the ScienceOne AI team of the Chinese Academy of Sciences.

S1-Omni addresses fragmented scientific AI capabilities with a shared backbone for cross-disciplinary, cross-modal, and cross-task understanding and reasoning, plus science-specific decoders for verifiable outputs. Unified encoding maps natural-language instructions and typed scientific objects, including material CIFs, chemical SMILES, protein sequences, spectra, and scientific images, into shared task representations. Knowledge alignment integrates scientific laws, experimental facts, and expert knowledge into data construction, validation, and training, grounding judgments in evidence. Task-oriented decoding converts the representations into verifiable outputs through specialized decoders for property prediction, spectrum-to-structure reconstruction, protein site and structure prediction, and scientific image generation and editing.

S1-Omni model architecture

📚 Dataset Introduction

S1-Omni-Corpus-10K is a representative open-source dataset subset curated from the S1-Omni training corpus. It contains 10,468 complete training samples and is intended for data-pipeline analysis, task-protocol research, and community reproduction.

S1-Omni-Corpus is a large-scale training corpus for unified scientific multimodal reasoning. It is organized around heterogeneous scientific data unification, expert-experience-aligned reasoning, and domain-native supervision. The corpus covers mathematics, physics, chemistry, biology, materials science, medicine, geography, astronomy, and computer science, and includes scientific question answering, literature reasoning, molecular and materials property prediction, protein function and binding-site prediction, protein-structure-related tasks, spectrum-to-molecular-structure prediction, and scientific image generation and editing.

S1-Omni-Corpus data distribution

The full S1-Omni-Corpus covers over 200 scientific tasks with million-scale reasoning samples. The S1-Omni-Corpus-10K subset released here preserves the complete training-sample format and can be used as a reference for understanding the S1-Omni data organization and task protocol.

🤗 Data Access

The open-source dataset is available from:

Platform URL
Hugging Face https://huggingface.co/datasets/ScienceOne-AI/S1-Omni-Corpus-10K
ModelScope https://modelscope.cn/datasets/ScienceOne-AI/S1-Omni-Corpus-10K

Local files:

File Description
S1-Omni-Corpus-10K.jsonl S1-Omni-Corpus-10K data file. Each line is one JSON training sample.
assets/ Resource directory referenced by multimodal samples such as images and spectra.

🧾 Data Format

Each JSONL record contains data_id, messages, images, and meta:

{
  "data_id": "XXXXXX",
  "messages": [
    {
      "role": "user",
      "content": "User question and scientific-object context"
    },
    {
      "role": "assistant",
      "content": "<think>...reasoning process...</think>\n\nModel response and task-specific token"
    }
  ],
  "images": [],
  "files": [],
  "meta": {
    "subject": "...",
    "task_type": "...",
    "language": "en",
    "turns": 1,
    "label": null
  }
}

Field descriptions:

  • data_id: Unique data ID.
  • messages: Data content. role contains user and assistant; content contains the user prompt, scientific-object context, and the assistant-side reasoning process and task answer.
  • images: Relative paths of user-input images. Missing values are represented as []. Image and spectra subsets use assets/... paths, while text-only records use [].
  • files: Relative paths of user-input files. Only the spectra subset uses non-empty values, pointing to assets/spectra_jdx/xxx.jdx; all other records use [].
  • meta: Metadata object containing only subject, task_type, language, turns, and label.

🏷️ Meta Fields

Field Type / Values Description
subject Discipline Chemistry, Biology, Medicine, Materials, CS, Physics, Geography, Math, Astronomy
task_type Task type Examples include IR spectrum to SMILES prediction, Protein PPI binding site prediction, Image editing, etc.
language Sample language en / zh
turns int Number of user turns. 1 means single-turn.
label object / null Annotation information. When non-null, it contains type and value; value is the decoder output object for the current scientific task.

🧩 Task-Specific Tokens

Task-specific tokens:

  • <image_edit> / <image_gen>: Image editing and image generation tasks
  • <prot_st> / <prot_cla>: Protein structure and protein classification tasks
  • <linear_pre> / <linear_cla>: Linear prediction and classification tasks
  • <spectra_st>: Spectrum-to-molecular-structure prediction task

📄 License

This dataset is released under the Apache License 2.0.

📖 Citation

If S1-Omni is useful for your research, please cite our technical report. The formal citation format will be updated after the paper or technical report is released.

@misc{s1omni2026,
  title  = {S1-Omni: A Unified Multimodal Reasoning Model for Scientific Understanding, Prediction, and Generation},
  author = {ScienceOne AI and Wenge AI},
  year   = {2026},
  url    = {https://arxiv.org/abs/2607.15686}
}
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