MOVE_PROBABILITIES

Parameters for fraction of moves performed for each move type. [Edit on GitHub]

Subsections

• BOX_PROBABILITIES
• MOL_PROBABILITIES

Keywords

• PMAVBMC

• PMCLTRANS

• PMHMC

• PMSWAP

• PMTRAION

• PMTRANS

• PMVOLUME

Keyword descriptions

PMAVBMC

Type: real
Default: 0.00000000E+000
Usage: PMAVBMC {real}

Description: The probability of attempting an AVBMC swap move. [Edit on GitHub]

PMCLTRANS

Type: real
Default: 0.00000000E+000
Usage: PMCLTRANS {real}

Description: The probability of attempting a cluster translation. [Edit on GitHub]

PMHMC

Type: real
Default: 0.00000000E+000
Usage: PMHMC {real}

Description: The probability of attempting a hybrid MC move. [Edit on GitHub]

PMSWAP

Type: real
Default: 0.00000000E+000
Usage: PMSWAP {real}

Description: The probability of attempting a swap move. [Edit on GitHub]

PMTRAION

Type: real
Usage: PMTRAION {real}

Description: The probability of attempting a conformational change. [Edit on GitHub]

PMTRANS

Type: real
Usage: PMTRANS {real}

Description: The probability of attempting a molecule translation. [Edit on GitHub]

PMVOLUME

Type: real
Default: 0.00000000E+000
Usage: PMVOLUME {real}

Description: The probability of attempting a volume move. [Edit on GitHub]