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Introduction to Mathematical Biology Osvaldo Chara Technische Universität Dresden, Germany [email protected] http://imc.zih.tu-dresden.de/imc/ Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday 1

Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

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Page 1: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

Introduction to Mathematical Biology

Osvaldo Chara Technische Universität Dresden, Germany

[email protected]

http://imc.zih.tu-dresden.de/imc/

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

1

Page 2: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

1. Modelling biological and biochemical process using ODEs Osvaldo Chara

Monday 13 and Tuesday 14, 9:00 to 10:30 h.

2. Modelling biological and biochemical process using PDEs Lutz Brusch

Wednsesday 15 and Thursday 16, 13:30 to 15:00 h.

Schedule

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 3: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

1. Modelling biological and biochemical process using ODEs Osvaldo Chara

Tuesday 14

9:00 to 10:30 h.

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 4: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

Yeah, I am still here

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 5: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

transport of water and non-electrolyte solutes

j

ej

ij

jwf cv

mAvP

t

v

d

d

Kedem & Katchalsky, 1958. Thermodynamic analysis of the permeability of biological membranes to non-electrolytes. Biochim. Biophys. Acta 27, 229-246. Kedem & Katchalsky, 1961. A physical interpretation of the phenomenological coefficients of membrane permeability. J. Gen. Physiol. 45: 143-179. Katchalsky & Curran, 1965. Non-equilibrium Thermodynamics in Biophysics. Harvard University Press, Cambridge, MA, USA. Kleinhans, 1998. Membrane permeability modeling: Kedem-Katchalsky vs a two-parameter formalism. Cryobiology. 37(4):271-89.

ej

ij

j

jc

v

mAP

t

m

d

d

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 6: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

electrolytes

Transport of electrolytes: Nernst equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 7: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

electrolytes

zoom

Transport of electrolytes: Nernst equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 8: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

one molecule of electrolyte

zoom

Transport of electrolytes: Nernst equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 9: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

let us see…

frictional force

electrical force

Transport of electrolytes: Nernst equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 10: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

The Flux cvJ d

Then ck

qEJ

Homogeneous concentration!

Transport of electrolytes: Nernst equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 11: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

The Flux

Thanks to Einstein we know that

x

cDc

k

qEJ

d

d

Then

D

Tkk B

Dx

c

Tk

qEcJ

B

d

d

This is the Nernst-Planck equation

Transport of electrolytes: Nernst equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 12: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

In equilibrium

Then

0J

Then

cz

c

Tk

qE

B

1

d

d

x

x

cx

Tk

qExx

B

dd

lndd

00

Transport of electrolytes: Nernst equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 13: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

Then

0

lnd0

c

xcxE

Tk

qx

B

x

VE

d

d

x

xEV0

d

xc

cV

Tk

q

B

0ln

But…

xc

c

q

TkV B 0

ln

The Nernst equation!

Transport of electrolytes: Nernst equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 14: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

xc

c

q

TkV B 0

ln

The Nernst equation!

I like it so much!

Transport of electrolytes: Nernst equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 15: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

x

VzFUc

x

cURTJ

d

d

d

d

a

V

x

V

d

d

Assuming …

This is again the Nernst-Planck equation

And …

bs cc

Transport of electrolytes: Goldman equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 16: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

a

VzFUc

dx

dcURTJ

ac

c

a

Ja

VzFcU

dcRTUdx

00

Then …

Integrating …

Transport of electrolytes: Goldman equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 17: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

RT

VzF

RT

VzF

ie

e

ecc

a

VzFUJ

1

b

e

s

e cc b

i

s

i cc But remember …

Therefore …

Transport of electrolytes: Goldman equation

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 18: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

RT

VzF

RT

VzF

ie

e

ecc

a

VzFUJ

1

Transport of electrolytes: Goldman equation

Goldman. 1943. Potential, Impedance, and Rectification in membranes. J Gen Physiol 27:37–60.

Hodgkin & Huxley, 1952. A quantitative description of membrane current and its application to conduction and excitation in nerve. J. Physiol. I I7, 500-544.

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 19: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

RT

VFz

RT

VFz

ijejjjj

jj

j

e

ecc

a

VFzUJ

1

j

ej

ij

jwf cv

mAvP

t

v

d

d

jj

jJr

t

m

d

d

Adding all up: the intracellular dynamics

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Page 20: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

An example: the dynamics of the extracellular ATP (ATPe)

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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ATPi

ATPe ADPe

k1

k2 k3

Page 21: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

An example: the dynamics of the extracellular ATP (ATPe)

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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eei

e ATPkATPATPkt

ATP21

d

d

ee

e ADPkATPkt

ADP32

d

d

0

d

d

t

ATPi

Page 22: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

An example: the dynamics of the extracellular ATP (ATPe)

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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eei ATPkATPATPk 210

ee ADPkATPk 320

0

d

d

d

d

t

ADP

t

ATP ee

21

1

kk

ATPkATP i

e

213

12

kkk

ATPkkADP i

e

Page 23: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

Some references of our work:

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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Chara O, Espelt MV, Krumschnabel G, Schwarzbaum PJ. 2011. Regulatory volume decrease and P receptor signaling in fish cells: mechanisms, physiology, and modeling approaches. J Exp Zool A Ecol Genet Physiol. 315(4):175-202. Chara O, Pafundo DE, Schwarzbaum PJ. 2010. Negative feedback of extracellular ADP on ATP release in goldfish hepatocytes: a theoretical study. J Theor Biol. 264(4):1147-58. Chara O, Pafundo DE, Schwarzbaum PJ. 2009. Kinetics of extracellular ATP from goldfish hepatocytes: a lesson from mathematical modeling. Bull Math Biol. 71(5):1025-47. Alleva K, Chara O, Sutka MR, Amodeo G. 2009. Analysis of the source of heterogeneity in the osmotic response of plant membrane vesicles. Eur Biophys J. 38(2):175-84. Pafundo DE, Chara O, Faillace MP, Krumschnabel G, Schwarzbaum PJ. 2008. Kinetics of ATP release and cell volume regulation of hyposmotically challenged goldfish hepatocytes. Am J Physiol Regul Integr Comp Physiol. 294(1):R220-33.

Page 24: Introduction to Mathematical Biology · 1. Modelling biological and biochemical process using ODEs Osvaldo Chara Monday 13 and Tuesday 14, 9:00 to 10:30 h. 2. Modelling biological

Osvaldo Chara Technische Universität Dresden, Germany

[email protected]

http://imc.zih.tu-dresden.de/imc/

Thanks a lot!

Osvaldo Chara - ESSIM - Dresden 2012 - Tuesday

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