Liang Wang

Xiangxin Zhou, Zichen Liu, Anya Sims et al.

The recent paradigm shift towards training large language models (LLMs) using DeepSeek-R1-Zero-style reinforcement learning (RL) on verifiable rewards has led to impressive advancements in code and mathematical reasoning. However, this methodology is limited to tasks where rule-based answer verification is possible and does not naturally extend to real-world domains such as chemistry, healthcare, engineering, law, biology, business, and economics. Current practical workarounds use an additional LLM as a model-based verifier; however, this introduces issues such as reliance on a strong verifier LLM, susceptibility to reward hacking, and the practical burden of maintaining the verifier model in memory during training. To address this and extend DeepSeek-R1-Zero-style training to general reasoning domains, we propose a verifier-free method (VeriFree) that bypasses answer verification and instead uses RL to directly maximize the probability of generating the reference answer. We compare VeriFree with verifier-based methods and demonstrate that, in addition to its significant practical benefits and reduced compute requirements, VeriFree matches and even surpasses verifier-based methods on extensive evaluations across MMLU-Pro, GPQA, SuperGPQA, and math-related benchmarks. Moreover, we provide insights into this method from multiple perspectives: as an elegant integration of training both the policy and implicit verifier in a unified model, and as a variational optimization approach. Code is available at https://github.com/sail-sg/VeriFree.

Xiangxin Zhou, Dongyu Xue, Ruizhe Chen et al.

Antibody design, a crucial task with significant implications across various disciplines such as therapeutics and biology, presents considerable challenges due to its intricate nature. In this paper, we tackle antigen-specific antibody sequence-structure co-design as an optimization problem towards specific preferences, considering both rationality and functionality. Leveraging a pre-trained conditional diffusion model that jointly models sequences and structures of antibodies with equivariant neural networks, we propose direct energy-based preference optimization to guide the generation of antibodies with both rational structures and considerable binding affinities to given antigens. Our method involves fine-tuning the pre-trained diffusion model using a residue-level decomposed energy preference. Additionally, we employ gradient surgery to address conflicts between various types of energy, such as attraction and repulsion. Experiments on RAbD benchmark show that our approach effectively optimizes the energy of generated antibodies and achieves state-of-the-art performance in designing high-quality antibodies with low total energy and high binding affinity simultaneously, demonstrating the superiority of our approach.

Liang Wang, Luis Carvalho

Model evaluation is of crucial importance in modern statistics application. The construction of ROC and calculation of AUC have been widely used for binary classification evaluation. Recent research generalizing the ROC/AUC analysis to multi-class classification has problems in at least one of the four areas: 1. failure to provide sensible plots 2. being sensitive to imbalanced data 3. unable to specify mis-classification cost and 4. unable to provide evaluation uncertainty quantification. Borrowing from a binomial matrix factorization model, we provide an evaluation metric summarizing the pair-wise multi-class True Positive Rate (TPR) and False Positive Rate (FPR) with one-dimensional vector representation. Visualization on the representation vector measures the relative speed of increment between TPR and FPR across all the classes pairs, which in turns provides a ROC plot for the multi-class counterpart. An integration over those factorized vector provides a binary AUC-equivalent summary on the classifier performance. Mis-clasification weights specification and bootstrapped confidence interval are also enabled to accommodate a variety of of evaluation criteria. To support our findings, we conducted extensive simulation studies and compared our method to the pair-wise averaged AUC statistics on benchmark datasets.

Deheng Ye, Guibin Chen, Wen Zhang et al.

MOBA games, e.g., Honor of Kings, League of Legends, and Dota 2, pose grand challenges to AI systems such as multi-agent, enormous state-action space, complex action control, etc. Developing AI for playing MOBA games has raised much attention accordingly. However, existing work falls short in handling the raw game complexity caused by the explosion of agent combinations, i.e., lineups, when expanding the hero pool in case that OpenAI's Dota AI limits the play to a pool of only 17 heroes. As a result, full MOBA games without restrictions are far from being mastered by any existing AI system. In this paper, we propose a MOBA AI learning paradigm that methodologically enables playing full MOBA games with deep reinforcement learning. Specifically, we develop a combination of novel and existing learning techniques, including curriculum self-play learning, policy distillation, off-policy adaption, multi-head value estimation, and Monte-Carlo tree-search, in training and playing a large pool of heroes, meanwhile addressing the scalability issue skillfully. Tested on Honor of Kings, a popular MOBA game, we show how to build superhuman AI agents that can defeat top esports players. The superiority of our AI is demonstrated by the first large-scale performance test of MOBA AI agent in the literature.

Deheng Ye, Guibin Chen, Peilin Zhao et al.

We present JueWu-SL, the first supervised-learning-based artificial intelligence (AI) program that achieves human-level performance in playing multiplayer online battle arena (MOBA) games. Unlike prior attempts, we integrate the macro-strategy and the micromanagement of MOBA-game-playing into neural networks in a supervised and end-to-end manner. Tested on Honor of Kings, the most popular MOBA at present, our AI performs competitively at the level of High King players in standard 5v5 games.

Liang Wang, Jinlong Liu, Jingming Liu

Beam search is an effective and widely used decoding algorithm in many sequence-to-sequence (seq2seq) text generation tasks. However, in open-ended text generation, beam search is often found to produce repetitive and generic texts, sampling-based decoding algorithms like top-k sampling and nucleus sampling are more preferred. Standard seq2seq models suffer from label bias due to its locally normalized probability formulation. This paper provides a series of empirical evidence that label bias is a major reason for such degenerate behaviors of beam search. By combining locally normalized maximum likelihood estimation and globally normalized sequence-level training, label bias can be reduced with almost no sacrifice in perplexity. To quantitatively measure label bias, we test the model's ability to discriminate the groundtruth text and a set of context-agnostic distractors. We conduct experiments on large-scale response generation datasets. Results show that beam search can produce more diverse and meaningful texts with our approach, in terms of both automatic and human evaluation metrics. Our analysis also suggests several future working directions towards the grand challenge of open-ended text generation.

Wang Liang

This paper presents a novel method to segment/decode DNA sequences based on n-grams statistical language model. Firstly, we find the length of most DNA 'words' is 12 to 15 bps by analyzing the genomes of 12 model species. Then we design an unsupervised probability based approach to segment the DNA sequences. The benchmark of segmenting method is also proposed.