The GROMOS Biomolecular Simulation Program Package

Article Properties
  • Language
    English
  • DOI (url)
  • Publication Date
    1999/04/24
  • Indian UGC (journal)
  • Refrences
    32
  • Citations
    1,120
  • Walter R. P. Scott Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
  • Philippe H. Hünenberger Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
  • Ilario G. Tironi Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
  • Alan E. Mark Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
  • Salomon R. Billeter Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
  • Jens Fennen Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
  • Andrew E. Torda Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
  • Thomas Huber Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
  • Peter Krüger Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
  • Wilfred F. van Gunsteren Laboratory of Physical Chemistry, ETH Zentrum, CH-8092 Zürich, Switzerland
Refrences
Title Journal Journal Categories Citations Publication Date
A generalized reaction field method for molecular dynamics simulations

The Journal of Chemical Physics
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Physics: Atomic physics. Constitution and properties of matter
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
1,151 1995
10.1007/BF00197812 Journal of Biomolecular NMR
  • Science: Biology (General)
  • Science: Chemistry: Analytical chemistry
  • Science: Biology (General)
  • Science: Chemistry: Organic chemistry: Biochemistry
  • Science: Biology (General)
  • Science: Chemistry: Organic chemistry: Biochemistry
1995
Avoiding singularities and numerical instabilities in free energy calculations based on molecular simulations Chemical Physics Letters
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Physics: Atomic physics. Constitution and properties of matter
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
830 1994
Molecular dynamics free energy calculation in four dimensions

The Journal of Chemical Physics
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Physics: Atomic physics. Constitution and properties of matter
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
26 1994
10.1007/BF00124016 Journal of Computer-Aided Molecular Design
  • Science: Biology (General)
  • Science: Biology (General)
  • Science: Physics
  • Science: Mathematics: Instruments and machines: Electronic computers. Computer science
  • Science: Chemistry: Analytical chemistry
  • Science: Chemistry
1994
Citations
Title Journal Journal Categories Citations Publication Date
A brief history of amyloid aggregation simulations

WIREs Computational Molecular Science
  • Science: Chemistry: General. Including alchemy
  • Medicine: Medicine (General): Computer applications to medicine. Medical informatics
  • Science: Biology (General)
  • Science: Chemistry
2024
Novel scaffolds identification against Mpro of SARS-CoV-2 using shape based screening and molecular simulation methods Chemical Physics Impact
  • Science: Chemistry: Physical and theoretical chemistry
2024
Solvents (Polar and non-polar) molecular interaction, antibonding & nonbonding, thermodynamic and MD simulation analysis on 1-(4-Aminophenyl)-4-(4-methoxyphenyl) piperazine − Antipsychotic drug Journal of Molecular Liquids
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Physics: Atomic physics. Constitution and properties of matter
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
2024
Conformational stability, quantum computational (DFT), vibrational, electronic and non-covalent interactions (QTAIM, RDG and IGM) of antibacterial compound N-(1-naphthyl)ethylenediamine dihydrochloride Journal of Molecular Structure
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
9 2024
Perturbative Expansion in Reciprocal Space: Bridging Microscopic and Mesoscopic Descriptions of Molecular Interactions The Journal of Physical Chemistry B
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry: Physical and theoretical chemistry
  • Science: Chemistry
2024
Citations Analysis
Category Category Repetition
Science: Chemistry571
Science: Biology (General)416
Science: Chemistry: Physical and theoretical chemistry351
Science: Chemistry: Organic chemistry: Biochemistry328
Science: Physics238
Science: Physics: Atomic physics. Constitution and properties of matter220
Science: Chemistry: General. Including alchemy191
Science: Chemistry: Analytical chemistry120
Science: Mathematics: Instruments and machines: Electronic computers. Computer science78
Medicine: Therapeutics. Pharmacology70
Medicine: Medicine (General): Computer applications to medicine. Medical informatics45
Science: Science (General)41
Science: Biology (General): Genetics37
Medicine: Public aspects of medicine: Toxicology. Poisons35
Science: Microbiology34
Medicine27
Science: Chemistry: Organic chemistry25
Science25
Science: Biology (General): Cytology25
Technology: Chemical technology: Polymers and polymer manufacture24
Technology: Chemical technology: Biotechnology23
Technology: Chemical technology22
Technology: Electrical engineering. Electronics. Nuclear engineering: Materials of engineering and construction. Mechanics of materials20
Science: Science (General): Cybernetics: Information theory18
Science: Chemistry: Crystallography17
Technology: Chemical technology: Chemical engineering15
Science: Mathematics13
Science: Physics: Nuclear and particle physics. Atomic energy. Radioactivity9
Medicine: Medicine (General)9
Agriculture8
Agriculture: Agriculture (General)8
Science: Chemistry: Inorganic chemistry8
Technology: Environmental technology. Sanitary engineering7
Technology: Engineering (General). Civil engineering (General)6
Geography. Anthropology. Recreation: Environmental sciences6
Medicine: Internal medicine: Specialties of internal medicine: Immunologic diseases. Allergy6
Science: Botany: Plant ecology5
Science: Physics: Heat: Thermodynamics5
Social Sciences: Industries. Land use. Labor: Special industries and trades: Energy industries. Energy policy. Fuel trade4
Science: Biology (General): Ecology4
Agriculture: Plant culture4
Agriculture: Animal culture4
Medicine: Internal medicine: Infectious and parasitic diseases4
Technology: Chemical technology: Food processing and manufacture3
Science: Zoology3
Medicine: Pharmacy and materia medica3
Science: Botany2
Medicine: Other systems of medicine2
Science: Mathematics: Probabilities. Mathematical statistics2
Medicine: Medicine (General): Medical technology2
Medicine: Internal medicine: Special situations and conditions: Industrial medicine. Industrial hygiene2
Medicine: Internal medicine: Specialties of internal medicine: Diseases of the endocrine glands. Clinical endocrinology2
Science: Biology (General): Evolution2
Medicine: Internal medicine: Neoplasms. Tumors. Oncology. Including cancer and carcinogens2
Science: Astronomy1
Technology: Engineering (General). Civil engineering (General): Environmental engineering1
Technology: Technology (General): Industrial engineering. Management engineering1
Technology: Building construction: Architectural engineering. Structural engineering of buildings1
Technology: Technology (General): Industrial engineering. Management engineering: Information technology1
Technology: Electrical engineering. Electronics. Nuclear engineering: Telecommunication1
Technology: Home economics: Nutrition. Foods and food supply1
Law: Law in general. Comparative and uniform law. Jurisprudence: Comparative law. International uniform law: Medical legislation1
Science: Astronomy: Astrophysics1
Technology: Chemical technology: Fuel1
Technology: Mechanical engineering and machinery: Renewable energy sources1
Medicine: Internal medicine: Neurosciences. Biological psychiatry. Neuropsychiatry1
Technology: Mechanical engineering and machinery1
Technology: Electrical engineering. Electronics. Nuclear engineering: Electronics1
Technology: Manufactures: Production management. Operations management1
Technology: Technology (General): Industrial engineering. Management engineering: Applied mathematics. Quantitative methods1
Medicine: Internal medicine: Neurosciences. Biological psychiatry. Neuropsychiatry: Neurology. Diseases of the nervous system1
Technology: Mining engineering. Metallurgy1
Science: Mathematics: Instruments and machines: Electronic computers. Computer science: Computer software1
Technology: Electrical engineering. Electronics. Nuclear engineering: Electronics: Computer engineering. Computer hardware1
Medicine: Internal medicine: Specialties of internal medicine1
Science: Physiology1
Science: Physiology: Animal biochemistry1
Agriculture: Animal culture: Veterinary medicine1
The category Science: Chemistry 571 is the most commonly referenced area in studies that cite this article. The first research to cite this article was titled Calculations of Relative Hydration Free Energies:  A Comparative Study Using Thermodynamic Integration and an Extrapolation Method Based on a Single Reference State and was published in 1999. The most recent citation comes from a 2024 study titled Expanding the CHARMM36 United Atom Chain Model for the Inclusion of Sphingolipids. This article reached its peak citation in 2014, with 69 citations. It has been cited in 288 different journals, 15% of which are open access. Among related journals, the The Journal of Physical Chemistry B cited this research the most, with 73 citations. The chart below illustrates the annual citation trends for this article.
Citations used this article by year