Dongkyu Lee

Hojung Jung, Youngrok Park, Laura Schmid et al.

Diffusion models have demonstrated remarkable success in various domains, including molecular generation. However, conditional molecular generation remains a fundamental challenge due to an intrinsic trade-off between targeting specific chemical properties and generating meaningful samples from the data distribution. In this work, we present Time-Aware Conditional Synthesis (TACS), a novel approach to conditional generation on diffusion models. It integrates adaptively controlled plug-and-play "online" guidance into a diffusion model, driving samples toward the desired properties while maintaining validity and stability. A key component of our algorithm is our new type of diffusion sampler, Time Correction Sampler (TCS), which is used to control guidance and ensure that the generated molecules remain on the correct manifold at each reverse step of the diffusion process at the same time. Our proposed method demonstrates significant performance in conditional 3D molecular generation and offers a promising approach towards inverse molecular design, potentially facilitating advancements in drug discovery, materials science, and other related fields.

Zhiliang Tian, Wei Bi, Zihan Zhang et al.

Personalized conversation models (PCMs) generate responses according to speaker preferences. Existing personalized conversation tasks typically require models to extract speaker preferences from user descriptions or their conversation histories, which are scarce for newcomers and inactive users. In this paper, we propose a few-shot personalized conversation task with an auxiliary social network. The task requires models to generate personalized responses for a speaker given a few conversations from the speaker and a social network. Existing methods are mainly designed to incorporate descriptions or conversation histories. Those methods can hardly model speakers with so few conversations or connections between speakers. To better cater for newcomers with few resources, we propose a personalized conversation model (PCM) that learns to adapt to new speakers as well as enabling new speakers to learn from resource-rich speakers. Particularly, based on a meta-learning based PCM, we propose a task aggregator (TA) to collect other speakers' information from the social network. The TA provides prior knowledge of the new speaker in its meta-learning. Experimental results show our methods outperform all baselines in appropriateness, diversity, and consistency with speakers.

Zhiliang Tian, Wei Bi, Dongkyu Lee et al.

Neural conversation models are known to generate appropriate but non-informative responses in general. A scenario where informativeness can be significantly enhanced is Conversing by Reading (CbR), where conversations take place with respect to a given external document. In previous work, the external document is utilized by (1) creating a context-aware document memory that integrates information from the document and the conversational context, and then (2) generating responses referring to the memory. In this paper, we propose to create the document memory with some anticipated responses in mind. This is achieved using a teacher-student framework. The teacher is given the external document, the context, and the ground-truth response, and learns how to build a response-aware document memory from three sources of information. The student learns to construct a response-anticipated document memory from the first two sources, and the teacher's insight on memory creation. Empirical results show that our model outperforms the previous state-of-the-art for the CbR task.