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Group-based reinforcement learning methods, like Group Relative Policy Optimization (GRPO), are widely used nowadays to post-train large language models. Despite their empirical success, they exhibit structural mismatches between reward…

Machine Learning · Computer Science 2026-01-09 Aleksandar Fontana , Marco Simoni , Giulio Rossolini , Andrea Saracino , Paolo Mori

Optimal subset selection is an important task that has numerous algorithms designed for it and has many application areas. STPGA contains a special genetic algorithm supplemented with a tabu memory property (that keeps track of previously…

Methodology · Statistics 2017-02-28 Deniz Akdemir

Energy based models (EBMs) are appealing for their generality and simplicity in data likelihood modeling, but have conventionally been difficult to train due to the unstable and time-consuming implicit MCMC sampling during contrastive…

Machine Learning · Computer Science 2024-07-23 Junn Yong Loo , Michelle Adeline , Arghya Pal , Vishnu Monn Baskaran , Chee-Ming Ting , Raphael C. -W. Phan

Bayesian optimization (BO) has recently become more prevalent in protein engineering applications and hence has become a fruitful target of benchmarks. However, current BO comparisons often overlook real-world considerations like risk and…

Machine Learning · Computer Science 2025-04-03 Tudor-Stefan Cotet , Igor Krawczuk

Genetic programming has undergone rapid development in recent years. However, theoretical studies of genetic programming are far behind. One of the major obstacles to theoretical studies is the challenge of developing a model to describe…

Neural and Evolutionary Computing · Computer Science 2025-05-29 Zhixing Huang , Yi Mei , Fangfang Zhang , Mengjie Zhang , Wolfgang Banzhaf

While preference optimization is crucial for improving visual generative models, how to effectively scale this paradigm remains largely unexplored. Current open-source preference datasets contain conflicting preference patterns, where…

Computer Vision and Pattern Recognition · Computer Science 2026-04-30 Ming Li , Jie Wu , Justin Cui , Xiaojie Li , Rui Wang , Chen Chen

Large reasoning models (LRMs) exhibit diverse high-level reasoning patterns (e.g., direct solution, reflection-and-verification, and exploring multiple solutions), yet prevailing training recipes implicitly bias models toward a limited set…

Artificial Intelligence · Computer Science 2026-01-13 Hanbin Wang , Jingwei Song , Jinpeng Li , Fei Mi , Lifeng Shang

Deep generative models that learn from the distribution of natural protein sequences and structures may enable the design of new proteins with valuable functions. While the majority of today's models focus on generating either sequences or…

Biomolecules · Quantitative Biology 2024-10-03 Chentong Wang , Sarah Alamdari , Carles Domingo-Enrich , Ava Amini , Kevin K. Yang

Generative adversarial networks (GANs) form a generative modeling approach known for producing appealing samples, but they are notably difficult to train. One common way to tackle this issue has been to propose new formulations of the GAN…

Machine Learning · Computer Science 2020-09-01 Gauthier Gidel , Hugo Berard , Gaëtan Vignoud , Pascal Vincent , Simon Lacoste-Julien

Generative models, particularly diffusion models, have achieved remarkable success in density estimation for multimodal data, drawing significant interest from the reinforcement learning (RL) community, especially in policy modeling in…

Machine Learning · Computer Science 2024-12-03 Jinouwen Zhang , Rongkun Xue , Yazhe Niu , Yun Chen , Jing Yang , Hongsheng Li , Yu Liu

Generative Adversarial Networks (GANs) have achieved remarkable results in the task of generating realistic natural images. In most successful applications, GAN models share two common aspects: solving a challenging saddle point…

Machine Learning · Statistics 2019-05-21 Piotr Bojanowski , Armand Joulin , David Lopez-Paz , Arthur Szlam

We apply a new approach to the reverse protein folding problem. Our method uses a minimization function in the design process which is different from the energy function used for folding. For a lattice model, we show that this new approach…

Condensed Matter · Physics 2009-10-28 J. M. Deutsch , Tanya Kurosky

The protein design problem involves finding polypeptide sequences folding into a given threedimensional structure. Its rigorous algorithmic solution is computationally demanding, involving a nested search in sequence and structure spaces.…

Quantum Physics · Physics 2024-07-11 Veronica Panizza , Philipp Hauke , Cristian Micheletti , Pietro Faccioli

Despite recent advances in Large Video Language Models (LVLMs), they still struggle with fine-grained temporal understanding, hallucinate, and often make simple mistakes on even simple video question-answering tasks, all of which pose…

Computer Vision and Pattern Recognition · Computer Science 2025-09-30 Pritam Sarkar , Ali Etemad

A key challenge in applying reinforcement learning (RL) to diffusion large language models (dLLMs) lies in the intractability of their likelihood functions, which are essential for the RL objective, necessitating corresponding approximation…

Machine Learning · Computer Science 2025-10-15 Nianyi Lin , Jiajie Zhang , Lei Hou , Juanzi Li

While modern biotechnologies allow synthesizing new proteins and function measurements at scale, efficiently exploring a protein sequence space and engineering it remains a daunting task due to the vast sequence space of any given protein.…

Biomolecules · Quantitative Biology 2024-01-15 Jiahao Qiu , Hui Yuan , Jinghong Zhang , Wentao Chen , Huazheng Wang , Mengdi Wang

Reinforcement learning with verifiable rewards (RLVR) has become a practical route to improve large language model reasoning, and Group Relative Policy Optimization (GRPO) is a widely used optimizer in this setting. However, RLVR training…

Machine Learning · Computer Science 2026-05-14 Tue Le , Linh Ngo Van , Trung Le

Bayesian optimization (BO) is a powerful framework to optimize black-box expensive-to-evaluate functions via sequential interactions. In several important problems (e.g. drug discovery, circuit design, neural architecture search, etc.),…

Machine Learning · Computer Science 2025-02-25 Melis Ilayda Bal , Pier Giuseppe Sessa , Mojmir Mutny , Andreas Krause

On-policy reinforcement learning (RL), particularly Proximal Policy Optimization (PPO) and Group Relative Policy Optimization (GRPO), has become the dominant paradigm for fine-tuning large language models (LLMs). While policy ratio clipping…

Machine Learning · Computer Science 2026-01-08 Yu Luo , Shuo Han , Yihan Hu , Dong Li , Jianye Hao

Large Vision-Language Models (LVLMs) hold immense potential for complex multimodal instruction following, yet their development is often hindered by the high cost and inconsistency of human annotation required for effective fine-tuning and…

Computation and Language · Computer Science 2025-08-19 Ruirui Gao , Emily Johnson , Bowen Tan , Yanfei Qian