Peter L. Cummins - Publications, H-index & Citations

Peter L. Cummins

Australian National University

30H指数

128论文数

3.8K被引数

收录论文 16

发表时间

The Coevolution of RuBisCO, Photorespiration, and Carbon Concentrating Mechanisms in Higher Plants

FRONTIERS IN PLANT SCIENCE

IF4.8

2021-09-01

OAAI

Cummins, Peter L.

Response: Commentary: Directions for Optimization of Photosynthetic Carbon Fixation: RuBisCO's Efficiency May Not Be So Constrained After All

FRONTIERS IN PLANT SCIENCE

IF4.8

2019-11-22

OAAI

Cummins, Peter L.; Kannappan, Babu; Gready, Jill E.

Revised mechanism of carboxylation of ribulose-1,5-biphosphate by rubisco from large scale quantum chemical calculations

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2018-05-14

PREAI

Cummins, Peter L.; Kannappan, Babu; Gready, Jill E.

Directions for Optimization of Photosynthetic Carbon Fixation: RuBisCO's Efficiency May Not Be So Constrained After All

FRONTIERS IN PLANT SCIENCE

IF4.8

2018-03-01

OAAI

Cummins, Peter L.; Kannappan, Babu; Gready, Jill E.

Calculation of a complete enzymic reaction surface: Reaction and activation free energies for hydride-ion transfer in dihydrofolate reductase

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2007-03-29

PREAI

Cummins, Peter L.; Rostov, Ivan V.; Gready, Jill E.

Multiple ligand-binding modes in bacterial R67 dihydrofolate reductase

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

IF3.1

2005-03-01

PREAI

Alonso, H; Gillies, MB; Cummins, PL; Bliznyuk, AA; Gready, JE

Computational methods for the study of enzymic reaction mechanisms III: A perturbation plus QM/MM approach for calculating relative free energies of protonation 研究酶反应机理的计算方法III: 计算质子化相对自由能的扰动加QM/MM方法

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2005-02-23

PREAI

Cummins, PL; Gready, JE

Conformation of prion protein repeat peptides probed by FRET measurements and molecular dynamics simulations

BIOPHYSICAL JOURNAL

IF3.1

2004-04-01

OAAI

Gustiananda, M; Liggins, JR; Cummins, PL; Gready, JE

Comparison of linear-scaling semiempirical methods and combined quantum mechanical/molecular mechanical methods for enzymic reactions. II. An energy decomposition analysis

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2002-08-13

PREAI

Titmuss, SJ; Cummins, PL; Rendell, AP; Bliznyuk, AA; Gready, JE

MOLECULAR-DYNAMICS FREE-ENERGY PERTURBATION STUDY ON THE RELATIVE AFFINITIES OF THE BINDING OF REDUCED AND OXIDIZED NADP TO DIHYDROFOLATE-REDUCTASE

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2002-05-01

PREAI

CUMMINS, PL; RAMNARAYAN, K; SINGH, UC; GREADY, JE

Energetically most likely substrate and active-site protonation sites and pathways in the catalytic mechanism of dihydrofolate reductase

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2001-03-23

PREAI

Cummins, PL; Gready, JE

Coupled semiempirical quantum mechanics and molecular mechanics (QM/MM) calculations on the aqueous solvation free energies of ionized molecules 电离分子的水溶剂化自由能的半经验量子力学和分子力学 (QM/MM) 耦合计算

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

1999-07-30

PREAI

Cummins, PL; Gready, JE

Molecular dynamics and free energy perturbation study of hydride-ion transfer step in dihydrofolate reductase using combined quantum and molecular mechanical model 结合量子和分子力学模型研究二氢叶酸还原酶中氢化物离子转移步骤的分子动力学和自由能扰动

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

1998-06-01

PREAI

Cummins, PL; Gready, JE

Coupled semiempirical molecular orbital and molecular mechanics model (QM/MM) for organic molecules in aqueous solution

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

1997-09-01

PREAI

Cummins, PL; Gready, JE

Solvent effects in active-site molecular dynamics simulations on the binding of 8-methyl-N5-deazapterin and 8-methylpterin to dihydrofolate reductase

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

1996-11-15

PREAI

Cummins, PL; Gready, JE

DEVELOPMENT AND MANAGEMENT OF UNIVERSITY-RESEARCH GROUPS - SMITH,RV

HIGHER EDUCATION

IF4.6

1989-01-01

PREAI

CUMMINS, P

研究方向