A. T. Hagler
University of Massachusetts Amherst(US)Tris Pharma (United States)(US)
Publications by Year
Research Areas
Protein Structure and Dynamics, Advanced Chemical Physics Studies, Spectroscopy and Quantum Chemical Studies, Crystallography and molecular interactions, Chemical Synthesis and Analysis
Most-Cited Works
- → Structure and energetics of ligand binding to proteins: Escherichia coli dihydrofolate reductase‐trimethoprim, a drug‐receptor system(1988)2,045 cited
- → An ab Initio CFF93 All-Atom Force Field for Polycarbonates(1994)1,236 cited
- → Derivation of class II force fields. I. Methodology and quantum force field for the alkyl functional group and alkane molecules(1994)815 cited
- → Energy functions for peptides and proteins. I. Derivation of a consistent force field including the hydrogen bond from amide crystals(1974)669 cited
- → Derivation of force fields for molecular mechanics and dynamics from ab initio energy surfaces(1988)599 cited
- → Consistent force field studies of intermolecular forces in hydrogen-bonded crystals. 1. Carboxylic acids, amides, and the C:O.cntdot..cntdot..cntdot.H- hydrogen bonds(1979)508 cited