A FAST ALGORITHM FOR THE INTERACTIVE DOCKING MANEUVER WITH FLEXIBLE MACROMOLECULES AND PROBES

被引：6

作者：

KARFUNKEL, HR

机构：

来源：

JOURNAL OF COMPUTATIONAL CHEMISTRY | 1986年 / 7卷 / 02期

关键词：

D O I：

10.1002/jcc.540070204

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：113 / 128

页数：16

共 39 条

[1] RAPID CALCULATION OF 1ST AND 2ND DERIVATIVES OF CONFORMATIONAL ENERGY WITH RESPECT TO DIHEDRAL ANGLES FOR PROTEINS - GENERAL RECURRENT EQUATIONS [J].

ABE, H ;

BRAUN, W ;

NOGUTI, T ;

GO, N .

COMPUTERS & CHEMISTRY, 1984, 8 (04) :239-247

[2] CONFORMATIONAL-ANALYSIS OF SUGAR RING IN NUCLEOSIDES AND NUCLEOTIDES - NEW DESCRIPTION USING CONCEPT OF PSEUDOROTATION [J].

ALTONA, C ;

SUNDARALINGAM, M .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1972, 94 (23) :8205-+

[3]

[Anonymous], 1968, THEORETICAL ELASTICI

[4] DESIGNING DRUGS TO FIT A MACROMOLECULAR RECEPTOR [J].

BEDDELL, CR .

CHEMICAL SOCIETY REVIEWS, 1984, 13 (03) :279-319

[5]

Blake CCF, 1978, CIBA F S, V60, P137

[6] BINDING OF FLEXIBLE LIGANDS TO MACROMOLECULES [J].

BURGEN, ASV ;

ROBERTS, GCK ;

FEENEY, J .

NATURE, 1975, 253 (5494) :753-755

[7]

Califano S., 1976, VIBRATIONAL STATES

[8] A FAST COMPUTER-PROGRAM FOR CONFORMATIONAL-ANALYSIS [J].

CASTELLANI, G ;

SCORDAMAGLIA, R .

COMPUTERS & CHEMISTRY, 1984, 8 (02) :127-131

[9]

DEAN PM, 1983, PERSPECT COMPUT, V3, P14

[10] ENERGY PARAMETERS IN POLYPEPTIDES .8. EMPIRICAL POTENTIAL-ENERGY ALGORITHM FOR CONFORMATIONAL-ANALYSIS OF LARGE MOLECULES [J].

DUNFIELD, LG ;

BURGESS, AW ;

SCHERAGA, HA .

JOURNAL OF PHYSICAL CHEMISTRY, 1978, 82 (24) :2609-2616

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