publication venue for
- Accurate Estimation of Solvation Free Energy Using Polynomial Fitting Techniques. 32:134-141. 2011
- DockoMatic: automated peptide analog creation for high throughput virtual screening. 32:2936-2941. 2011
- Use of polynomial interpolation to reduce bias and uncertainty of free energy estimates via thermodynamic integration. 32:134-134. 2011
- Reducing the Bias and Uncertainty of Free Energy Estimates by Using Regression to Fit Thermodynamic Integration Data. 30:2297-2304. 2009
- Efficient use of non-equilibrium measurement to estimate free energy differences for molecular systems. 25. 2004
- B3LYP calculations on bishomoaromaticity in substituted semibullvalenes. 22:1565-1573. 2001