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1
Corregendum to "an ab initio study of the peptide bond formation between alanine and glycine electron correlation effetcs on the structure and binding energy". [J. Mol. Struct. (Theochem) 577 (2002 267-279]
Corregendum to "an ab initio study of the peptide bond formation between alanine and glycine electron correlation effetcs on the structure and binding energy". [J. Mol. Struct. (Theochem) 577 (2002 267-279]
Material Type:
Artigo 		Adicionar ao Meu Espaço

Corregendum to "an ab initio study of the peptide bond formation between alanine and glycine electron correlation effetcs on the structure and binding energy". [J. Mol. Struct. (Theochem) 577 (2002 267-279]

Puspitapallab Chaudhuri Sylvio Canuto

Journal of Molecular Structure-Theochem Amsterdam v. 586, n. 1-3, p. 241, 2002

Amsterdam 2002

Acesso online

2
an ab initio study of the peptide bond formation between alanine and glycine electron correlation effects on the structure and binding energy
an ab initio study of the peptide bond formation between alanine and glycine electron correlation effects on the structure and binding energy
Material Type:
Artigo 		Adicionar ao Meu Espaço

an ab initio study of the peptide bond formation between alanine and glycine electron correlation effects on the structure and binding energy

Puspitapallab Chaudhuri Sylvio Canuto

Journal of Molecular Structure-Theochem Amsterdam v. 577, n. 2-3, p. 267-279, 2002

Amsterdam 2002

Acesso online

3
The sequential Monte Carlo-quantum mechanics methodology. Application to the solvent effects in the Stokes shift of acetone in water
The sequential Monte Carlo-quantum mechanics methodology. Application to the solvent effects in the Stokes shift of acetone in water
Material Type:
Artigo 		Adicionar ao Meu Espaço

The sequential Monte Carlo-quantum mechanics methodology. Application to the solvent effects in the Stokes shift of acetone in water

Kaline Rabelo Coutinho Sylvio Canuto

Journal of Molecular Structure-Theochem v. 632, n. 1-3, p. 235-246, 2003

Amsterdam 2003

Acesso online

4
Conformational behavior of different possible ways of oligoglycine formation in a solvent-free environment
Conformational behavior of different possible ways of oligoglycine formation in a solvent-free environment
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Conformational behavior of different possible ways of oligoglycine formation in a solvent-free environment

Puspitapallab Chaudhuri Sylvio Canuto

Journal of Molecular Structure-Theochem v. 849, n. 1-3, p. 25-32, 2008

Amsterdam 2008

Acesso online

5
an ab initio study of the peptide bond formation between alanine and glycine electron correlation effects on the structure and binding energy
an ab initio study of the peptide bond formation between alanine and glycine electron correlation effects on the structure and binding energy
Material Type:
Artigo 		Adicionar ao Meu Espaço

an ab initio study of the peptide bond formation between alanine and glycine electron correlation effects on the structure and binding energy

Puspitapallab Chaudhuri Sylvio Canuto

Journal of Molecular Structure-Theochem Amsterdam v. 577, n. 2-3, p. 267-279, 2002

Amsterdam 2002

Acesso online

6
Corregendum to "an ab initio study of the peptide bond formation between alanine and glycine electron correlation effetcs on the structure and binding energy". [J. Mol. Struct. (Theochem) 577 (2002 267-279]
Corregendum to "an ab initio study of the peptide bond formation between alanine and glycine electron correlation effetcs on the structure and binding energy". [J. Mol. Struct. (Theochem) 577 (2002 267-279]
Material Type:
Artigo 		Adicionar ao Meu Espaço

Corregendum to "an ab initio study of the peptide bond formation between alanine and glycine electron correlation effetcs on the structure and binding energy". [J. Mol. Struct. (Theochem) 577 (2002 267-279]

Puspitapallab Chaudhuri Sylvio Canuto

Journal of Molecular Structure-Theochem Amsterdam v. 586, n. 1-3, p. 241, 2002

Amsterdam 2002

Acesso online

7
The sequential Monte Carlo-quantum mechanics methodology. Application to the solvent effects in the Stokes shift of acetone in water
The sequential Monte Carlo-quantum mechanics methodology. Application to the solvent effects in the Stokes shift of acetone in water
Material Type:
Artigo 		Adicionar ao Meu Espaço

The sequential Monte Carlo-quantum mechanics methodology. Application to the solvent effects in the Stokes shift of acetone in water

Kaline Rabelo Coutinho Sylvio Canuto

Journal of Molecular Structure-Theochem v. 632, n. 1-3, p. 235-246, 2003

Amsterdam 2003

Acesso online

8
Conformational behavior of different possible ways of oligoglycine formation in a solvent-free environment
Conformational behavior of different possible ways of oligoglycine formation in a solvent-free environment
Material Type:
Artigo 		Adicionar ao Meu Espaço

Conformational behavior of different possible ways of oligoglycine formation in a solvent-free environment

Puspitapallab Chaudhuri Sylvio Canuto

Journal of Molecular Structure-Theochem v. 849, n. 1-3, p. 25-32, 2008

Amsterdam 2008

Acesso online

9
A Monte Carlo-quantum mechanics study of the spectroscopic properties of molecules in solution
A Monte Carlo-quantum mechanics study of the spectroscopic properties of molecules in solution
Material Type:
Artigo 		Adicionar ao Meu Espaço

A Monte Carlo-quantum mechanics study of the spectroscopic properties of molecules in solution

Kaline Rabelo Coutinho N Saavedra; A Serrano; Sylvio Canuto

Journal of Molecular Structure-Theochem Amsterdam v. 539, p. 171-179, 2001

Amsterdam 2001

Acesso online

10
A Monte Carlo-quantum mechanics study of the spectroscopic properties of molecules in solution
A Monte Carlo-quantum mechanics study of the spectroscopic properties of molecules in solution
Material Type:
Artigo 		Adicionar ao Meu Espaço

A Monte Carlo-quantum mechanics study of the spectroscopic properties of molecules in solution

Kaline Rabelo Coutinho N Saavedra; A Serrano; Sylvio Canuto

Journal of Molecular Structure-Theochem Amsterdam v. 539, p. 171-179, 2001

Amsterdam 2001

Acesso online

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Deste Autor:

  1. Canuto, S
  2. Chaudhuri, P
  3. Coutinho, K
  4. Saavedra, N
  5. Serrano, A

Neste Assunto:

  1. Biofísica
  2. Estrutura Molecular (Física Moderna)
  3. Estrutura Eletrônica
  4. Método De Monte Carlo
  5. Química

  • Realização: ABCD-USP USP   Logos de Redes Sociais: Freepik

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