Molly Schmidt

Biochemistry, Genetics and Molecular Biology · Life Sciences

6h-index150citations14works7.72yr avg
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Research Topics

Protein Structure and Dynamics(5), Computational Drug Discovery Methods(2), Complex Network Analysis Techniques(1), Thyroid Disorders and Treatments(1), Orthodontics and Dentofacial Orthopedics(1)

Publications14 total

Exploration of structure-activity relationships for the SARS-CoV-2 macrodomain from shape-based fragment linking and active learning
Science Advances·2025· 14 citedOpen Access
Extensive exploration of structure activity relationships for the SARS-CoV-2 macrodomain from shape-based fragment merging and active learning
2024· 9 citedOpen Access
Standardization of key performance indicators and metrics for investigational drug services: Consensus recommendations among IDS specialists
American Journal of Health-System Pharmacy·2024
Identification of GDC-1971 (RLY-1971), a SHP2 Inhibitor Designed for the Treatment of Solid Tumors
Journal of Medicinal Chemistry·2023· 37 citedOpen Access
Corrigendum to “Optimizing active learning for free energy Calculations” [Artificial Intelligence in the Life Sciences, 2 (2022) 100050]
Artificial Intelligence in the Life Sciences·2023Open Access
Optimizing active learning for free energy calculations
Artificial Intelligence in the Life Sciences·2022· 62 citedOpen Access
Mollack: a web server for the automated creation of conformational ensembles for intrinsically disordered proteins
Bioinformatics·2016· 6 cited
Analyzing Ensembles of Amyloid Proteins Using Bayesian Statistics
Methods in molecular biology·2015· 4 cited
Brief communication: Correcting overestimation when determining two‐dimensional occlusal area in human molars
American Journal of Physical Anthropology·2011· 6 citedOpen Access
Clinical-Anthropometric and Aesthetic Analysis of Nose and Lip in Unilateral Cleft Lip and Palate Patients
The Cleft Palate-Craniofacial Journal·2010· 12 cited
Congenital Upper Limb Deformities: Hand Function of Patients with Radius Dysplasia
2006
[Functional mandibular movements in comparison to tooth-guided border movements].
PubMed·1985
Putting the bite on mandibular deficiency.
PubMed·1984
[Methodical translation of recent findings of functional bite analysis and occlusal surface design into preclinical and preparatory dental education].
PubMed·1981

Frequent Co-authors

W. Patrick Walters(5), Brian Goldman(3), Jianwen A. Feng(2), Nicolas A Pabon(2), Hongcheng Xu(2), Forrest York(2), G.J. Correy(2), Moira Rachman(2), Takaya Togo(2), Stefan Gahbauer(2), Yagmur U. Doruk(2), Maisie GV Stevens(2), Priyadarshini Jaishankar(2), Brian Kelley(2), Trevor J. Kramer(2), Alan Ashworth(2), Patrick Riley(2), Brian K. Shoichet(2), Adam R. Renslo(2), James S. Fraser(2)